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Chemistry, part 1

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > n-[(2s,3s)-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide
organooxygen compound > n-[(2s,3s)-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide

Preferred term

n-[(2s,3s)-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(1-naphthalenylamino)-oxomethyl]amino]methyl]-6-oxo-3,4-dihydro-2h-1,5-benzoxazocin-8-yl]-3-(4-morpholinyl)propanamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C34H43N5O6

has_functional_parent

inchi

  • InChI=1S/C34H43N5O6/c1-23-20-39(24(2)22-40)33(42)28-19-26(35-32(41)13-14-38-15-17-44-18-16-38)11-12-30(28)45-31(23)21-37(3)34(43)36-29-10-6-8-25-7-4-5-9-27(25)29/h4-12,19,23-24,31,40H,13-18,20-22H2,1-3H3,(H,35,41)(H,36,43)/t23-,24-,31+/m0/s1

inchikey

  • NJKSMJYTSLFNSQ-ISTJGCCRSA-N

mass

  • 617.736

monoisotopicmass

  • 617.32133

smiles

  • C[C@H]1CN(C(=O)C2=C(C=CC(=C2)NC(=O)CCN3CCOCC3)O[C@@H]1CN(C)C(=O)NC4=CC=CC5=CC=CC=C54)[C@@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:111574

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