3-phenylpropyl 4-[methyl-[2-[(phenylmethyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 3-phenylpropyl 4-[methyl-[2-[(phenylmethyl)carbamoyl]phenyl]amino]-4-oxidanylidene-butanoate Openeye Name: 3-phenylpropyl 4-[2-(benzylcarbamoyl)-N-methyl-anilino]-4-oxo-butanoate CAS Name: 4-[N-methyl-2-[oxo-[(phenylmethyl)amino]methyl]anilino]-4-oxobutanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-[2-(benzylcarbamoyl)-N-methylanilino]-4-oxobutanoate Traditional Name: 4-[2-(benzylcarbamoyl)-N-methyl-anilino]-4-keto-butyric acid 3-phenylpropyl ester Formula: C28H30N2O4 MolecularWeight: 458.5488

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=O)CCC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CN(C1=CC=CC=C1C(=O)NCC2=CC=CC=C2)C(=O)CCC(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C28H30N2O4/c1-30(26(31)18-19-27(32)34-20-10-15-22-11-4-2-5-12-22)25-17-9-8-16-24(25)28(33)29-21-23-13-6-3-7-14-23/h2-9,11-14,16-17H,10,15,18-21H2,1H3,(H,29,33)