[2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-[(4-methylphenyl)amino]-4-oxidanylidene-butanoate

Systemtic Name: [2-oxidanylidene-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-[(4-methylphenyl)amino]-4-oxidanylidene-butanoate Openeye Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-(4-methylanilino)-4-oxo-butanoate CAS Name: 4-(4-methylanilino)-4-oxobutanoic acid [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 4-(4-methylanilino)-4-oxobutanoate Traditional Name: 4-keto-4-(p-toluidino)butyric acid [2-keto-2-[[(1R)-1-phenylethyl]amino]ethyl] ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CCC(=O)OCC(=O)NC(C)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CCC(=O)OCC(=O)N[C@H](C)C2=CC=CC=C2

InChI

InChI=1S/C21H24N2O4/c1-15-8-10-18(11-9-15)23-19(24)12-13-21(26)27-14-20(25)22-16(2)17-6-4-3-5-7-17/h3-11,16H,12-14H2,1-2H3,(H,22,25)(H,23,24)/t16-/m1/s1