[2-(3-chlorophenyl)-2-oxidanylidene-ethyl] 3-methyl-2-(phenylmethoxycarbonylamino)pentanoate

Systemtic Name: [2-(3-chlorophenyl)-2-oxidanylidene-ethyl] 3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Openeye Name: [2-(3-chlorophenyl)-2-oxo-ethyl] 2-(benzyloxycarbonylamino)-3-methyl-pentanoate CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)pentanoic acid [2-(3-chlorophenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-chlorophenyl)-2-oxoethyl] 3-methyl-2-(phenylmethoxycarbonylamino)pentanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-valeric acid [2-(3-chlorophenyl)-2-keto-ethyl] ester Formula: C22H24ClNO5 MolecularWeight: 417.88266

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OCC(=O)C1=CC(=CC=C1)Cl)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCC(C)C(C(=O)OCC(=O)C1=CC(=CC=C1)Cl)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C22H24ClNO5/c1-3-15(2)20(24-22(27)29-13-16-8-5-4-6-9-16)21(26)28-14-19(25)17-10-7-11-18(23)12-17/h4-12,15,20H,3,13-14H2,1-2H3,(H,24,27)