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

Systemtic Name: (phenylmethyl) 4-acetamido-5-[(4-methylphenyl)amino]-5-oxidanylidene-pentanoate Openeye Name: benzyl 4-acetamido-5-(4-methylanilino)-5-oxo-pentanoate CAS Name: 4-acetamido-5-(4-methylanilino)-5-oxopentanoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-acetamido-5-(4-methylanilino)-5-oxopentanoate Traditional Name: 4-acetamido-5-keto-5-(p-toluidino)valeric acid benzyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

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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)C

Isomeric SMILES

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

InChI

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