(phenylmethyl) 5-[(4-methylphenyl)amino]-5-oxidanylidene-4-(2-phenylethanoylamino)pentanoate

Systemtic Name: (phenylmethyl) 5-[(4-methylphenyl)amino]-5-oxidanylidene-4-(2-phenylethanoylamino)pentanoate Openeye Name: benzyl 5-(4-methylanilino)-5-oxo-4-[(2-phenylacetyl)amino]pentanoate CAS Name: 5-(4-methylanilino)-5-oxo-4-[(1-oxo-2-phenylethyl)amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(4-methylanilino)-5-oxo-4-[(2-phenylacetyl)amino]pentanoate Traditional Name: 5-keto-4-[(2-phenylacetyl)amino]-5-(p-toluidino)valeric acid benzyl ester Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(CCC(=O)OCC2=CC=CC=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(CCC(=O)OCC2=CC=CC=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C27H28N2O4/c1-20-12-14-23(15-13-20)28-27(32)24(29-25(30)18-21-8-4-2-5-9-21)16-17-26(31)33-19-22-10-6-3-7-11-22/h2-15,24H,16-19H2,1H3,(H,28,32)(H,29,30)