(2-oxidanylidenechromen-7-yl) 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: (2-oxidanylidenechromen-7-yl) 2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: (2-oxochromen-7-yl) 2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(4-methylanilino)-2-oxoethyl]thio]acetic acid (2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (2-oxochromen-7-yl) 2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-keto-2-(p-toluidino)ethyl]thio]acetic acid (2-ketochromen-7-yl) ester Formula: C20H17NO5S MolecularWeight: 383.41768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)OC2=CC3=C(C=C2)C=CC(=O)O3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)OC2=CC3=C(C=C2)C=CC(=O)O3

InChI

InChI=1S/C20H17NO5S/c1-13-2-6-15(7-3-13)21-18(22)11-27-12-20(24)25-16-8-4-14-5-9-19(23)26-17(14)10-16/h2-10H,11-12H2,1H3,(H,21,22)