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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CC=CC=C2NC(=O)CCC(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CC=CC=C2NC(=O)CCC(=O)OCCCC3=CC=CC=C3

InChI

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