ethyl 4-(4-chlorophenyl)-3-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxidanylidene-butanoate

Systemtic Name: ethyl 4-(4-chlorophenyl)-3-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxidanylidene-butanoate Openeye Name: ethyl 3-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-(4-chlorophenyl)-2-oxo-butanoate CAS Name: 4-(4-chlorophenyl)-3-[[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-2-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-3-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxobutanoate Traditional Name: 3-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-(4-chlorophenyl)-2-keto-butyric acid ethyl ester Formula: C26H31ClN2O6 MolecularWeight: 502.98714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=O)C(CC1=CC=C(C=C1)Cl)NC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)C(=O)C(CC1=CC=C(C=C1)Cl)NC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H31ClN2O6/c1-4-34-25(32)23(30)21(15-18-10-12-20(27)13-11-18)28-24(31)22(14-17(2)3)29-26(33)35-16-19-8-6-5-7-9-19/h5-13,17,21-22H,4,14-16H2,1-3H3,(H,28,31)(H,29,33)