[(2R)-1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3,4-diethoxyphenyl)carbonylbenzoate

Systemtic Name: [(2R)-1-[(2-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(3,4-diethoxyphenyl)carbonylbenzoate Openeye Name: [(1R)-1-methyl-2-(2-methylanilino)-2-oxo-ethyl] 2-(3,4-diethoxybenzoyl)benzoate CAS Name: 2-[(3,4-diethoxyphenyl)-oxomethyl]benzoic acid [(2R)-1-(2-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(2-methylanilino)-1-oxopropan-2-yl] 2-(3,4-diethoxybenzoyl)benzoate Traditional Name: 2-(3,4-diethoxybenzoyl)benzoic acid [(1R)-2-keto-1-methyl-2-(o-toluidino)ethyl] ester Formula: C28H29NO6 MolecularWeight: 475.53296

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OC(C)C(=O)NC3=CC=CC=C3C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O[C@H](C)C(=O)NC3=CC=CC=C3C)OCC

InChI

InChI=1S/C28H29NO6/c1-5-33-24-16-15-20(17-25(24)34-6-2)26(30)21-12-8-9-13-22(21)28(32)35-19(4)27(31)29-23-14-10-7-11-18(23)3/h7-17,19H,5-6H2,1-4H3,(H,29,31)/t19-/m1/s1