[(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 1-methylpyrrole-2-carboxylate

Systemtic Name: [(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 1-methylpyrrole-2-carboxylate Openeye Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenyl-ethyl] 1-methylpyrrole-2-carboxylate CAS Name: 1-methyl-2-pyrrolecarboxylic acid [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl] 1-methylpyrrole-2-carboxylate Traditional Name: 1-methylpyrrole-2-carboxylic acid [(1S)-2-keto-2-(o-phenetidino)-1-phenyl-ethyl] ester Formula: C22H22N2O4 MolecularWeight: 378.42108

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)OC(=O)C3=CC=CN3C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C2=CC=CC=C2)OC(=O)C3=CC=CN3C

InChI

InChI=1S/C22H22N2O4/c1-3-27-19-14-8-7-12-17(19)23-21(25)20(16-10-5-4-6-11-16)28-22(26)18-13-9-15-24(18)2/h4-15,20H,3H2,1-2H3,(H,23,25)/t20-/m0/s1