(4S)-5-[(4-methylphenyl)amino]-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (4S)-5-[(4-methylphenyl)amino]-5-oxidanylidene-4-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (4S)-4-(benzyloxycarbonylamino)-5-(4-methylanilino)-5-oxo-pentanoic acid CAS Name: (4S)-5-(4-methylanilino)-5-oxo-4-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (4S)-5-(4-methylanilino)-5-oxo-4-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (4S)-4-(benzyloxycarbonylamino)-5-keto-5-(p-toluidino)valeric acid Formula: C20H22N2O5 MolecularWeight: 370.39908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@H](CCC(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22N2O5/c1-14-7-9-16(10-8-14)21-19(25)17(11-12-18(23)24)22-20(26)27-13-15-5-3-2-4-6-15/h2-10,17H,11-13H2,1H3,(H,21,25)(H,22,26)(H,23,24)/t17-/m0/s1