bis(phenylmethyl) 2-[2-[(phenylmethyl)carbamoyl]cyclohex-2-en-1-yl]propanedioate

Systemtic Name: bis(phenylmethyl) 2-[2-[(phenylmethyl)carbamoyl]cyclohex-2-en-1-yl]propanedioate Openeye Name: dibenzyl 2-[2-(benzylcarbamoyl)cyclohex-2-en-1-yl]propanedioate CAS Name: 2-[2-[oxo-[(phenylmethyl)amino]methyl]-1-cyclohex-2-enyl]propanedioic acid bis(phenylmethyl) ester IUPAC Name: dibenzyl 2-[2-(benzylcarbamoyl)cyclohex-2-en-1-yl]propanedioate Traditional Name: 2-[2-(benzylcarbamoyl)cyclohex-2-en-1-yl]malonic acid dibenzyl ester Formula: C31H31NO5 MolecularWeight: 497.58154

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C(C(C1)C(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1CC=C(C(C1)C(C(=O)OCC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C31H31NO5/c33-29(32-20-23-12-4-1-5-13-23)27-19-11-10-18-26(27)28(30(34)36-21-24-14-6-2-7-15-24)31(35)37-22-25-16-8-3-9-17-25/h1-9,12-17,19,26,28H,10-11,18,20-22H2,(H,32,33)