[2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenylsulfanylpropanoate

Systemtic Name: [2-[(3,4-dimethoxyphenyl)amino]-2-oxidanylidene-ethyl] (2R)-2-phenylsulfanylpropanoate Openeye Name: [2-(3,4-dimethoxyanilino)-2-oxo-ethyl] (2R)-2-phenylsulfanylpropanoate CAS Name: (2R)-2-(phenylthio)propanoic acid [2-(3,4-dimethoxyanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethoxyanilino)-2-oxoethyl] (2R)-2-phenylsulfanylpropanoate Traditional Name: (2R)-2-(phenylthio)propionic acid [2-(3,4-dimethoxyanilino)-2-keto-ethyl] ester Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)NC1=CC(=C(C=C1)OC)OC)SC2=CC=CC=C2

Isomeric SMILES

C[C@H](C(=O)OCC(=O)NC1=CC(=C(C=C1)OC)OC)SC2=CC=CC=C2

InChI

InChI=1S/C19H21NO5S/c1-13(26-15-7-5-4-6-8-15)19(22)25-12-18(21)20-14-9-10-16(23-2)17(11-14)24-3/h4-11,13H,12H2,1-3H3,(H,20,21)/t13-/m1/s1