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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > olefinic compound > n-trans-cinnamoyl 2-amino-3a,4,5,6,7,8,9,10,11,12,13,13a-dodecahydrocyclododeca[d]oxazole

Preferred term

n-trans-cinnamoyl 2-amino-3a,4,5,6,7,8,9,10,11,12,13,13a-dodecahydrocyclododeca[d]oxazole  

Type

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

Broader concept

charge

  • 0

formula

  • C22H30N2O2

has_functional_parent

inchi

  • InChI=1S/C22H30N2O2/c25-21(17-16-18-12-8-7-9-13-18)24-22-23-19-14-10-5-3-1-2-4-6-11-15-20(19)26-22/h7-9,12-13,16-17,19-20H,1-6,10-11,14-15H2,(H,23,24,25)/b17-16+/t19-,20-/m1/s1

inchikey

  • XZORUNHMSUAKIS-YBNLGUDHSA-N

mass

  • 354.494

monoisotopicmass

  • 354.23073

smiles

  • O=C(NC=1O[C@@H]2CCCCCCCCCC[C@H]2N1)/C=C/C3=CC=CC=C3

subset

  • 2_STAR

synonym EXACT

  • (E)-N-[(3aR,13aR)-3a,4,5,6,7,8,9,10,11,12,13,13a-dodecahydrocyclododeca[d][1,3]oxazol-2-yl]-3-phenylprop-2-enamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:197880

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