dimethyl 2-[(S)-(2-chlorophenyl)-(phenylmethoxycarbonylamino)methyl]propanedioate

Systemtic Name: dimethyl 2-[(S)-(2-chlorophenyl)-(phenylmethoxycarbonylamino)methyl]propanedioate Openeye Name: dimethyl 2-[(S)-benzyloxycarbonylamino-(2-chlorophenyl)methyl]propanedioate CAS Name: 2-[(S)-(2-chlorophenyl)-(phenylmethoxycarbonylamino)methyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(S)-(2-chlorophenyl)-(phenylmethoxycarbonylamino)methyl]propanedioate Traditional Name: 2-[(S)-benzyloxycarbonylamino-(2-chlorophenyl)methyl]malonic acid dimethyl ester Formula: C20H20ClNO6 MolecularWeight: 405.8289

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(C1=CC=CC=C1Cl)NC(=O)OCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C([C@@H](C1=CC=CC=C1Cl)NC(=O)OCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H20ClNO6/c1-26-18(23)16(19(24)27-2)17(14-10-6-7-11-15(14)21)22-20(25)28-12-13-8-4-3-5-9-13/h3-11,16-17H,12H2,1-2H3,(H,22,25)/t17-/m1/s1