[(2R)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3,4,5-triethoxybenzoate

Systemtic Name: [(2R)-1-[(4-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 3,4,5-triethoxybenzoate Openeye Name: [(1R)-1-methyl-2-(4-methylanilino)-2-oxo-ethyl] 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid [(2R)-1-(4-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-methylanilino)-1-oxopropan-2-yl] 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid [(1R)-2-keto-1-methyl-2-(p-toluidino)ethyl] ester Formula: C23H29NO6 MolecularWeight: 415.47946

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OC(C)C(=O)NC2=CC=C(C=C2)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)O[C@H](C)C(=O)NC2=CC=C(C=C2)C

InChI

InChI=1S/C23H29NO6/c1-6-27-19-13-17(14-20(28-7-2)21(19)29-8-3)23(26)30-16(5)22(25)24-18-11-9-15(4)10-12-18/h9-14,16H,6-8H2,1-5H3,(H,24,25)/t16-/m1/s1