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Chemistry, part 1

Content language

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Concept information

organooxygen compound > ester > carboxylic ester > benzoate ester > 4-[[(2,3-dihydro-1h-inden-1-ylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester
organooxygen compound > carbonyl compound > carboxylic ester > benzoate ester > 4-[[(2,3-dihydro-1h-inden-1-ylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester

Preferred term

4-[[(2,3-dihydro-1h-inden-1-ylamino)-sulfanylidenemethyl]amino]benzoic acid methyl ester  

Type

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

Broader concept

charge

  • 0

formula

  • C18H18N2O2S

inchi

  • InChI=1S/C18H18N2O2S/c1-22-17(21)13-6-9-14(10-7-13)19-18(23)20-16-11-8-12-4-2-3-5-15(12)16/h2-7,9-10,16H,8,11H2,1H3,(H2,19,20,23)

inchikey

  • FWRVALXMNQZUCK-UHFFFAOYSA-N

mass

  • 326.414

monoisotopicmass

  • 326.10890

smiles

  • COC(=O)C1=CC=C(C=C1)NC(=S)NC2CCC3=CC=CC=C23

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:109757

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