methyl 6-oxidanylidene-5-[(4-phenylmethoxyphenyl)methyl]piperazine-2-carboxylate

Systemtic Name: methyl 6-oxidanylidene-5-[(4-phenylmethoxyphenyl)methyl]piperazine-2-carboxylate Openeye Name: methyl 5-[(4-benzyloxyphenyl)methyl]-6-oxo-piperazine-2-carboxylate CAS Name: 6-oxo-5-[(4-phenylmethoxyphenyl)methyl]-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl 6-oxo-5-[(4-phenylmethoxyphenyl)methyl]piperazine-2-carboxylate Traditional Name: 5-(4-benzoxybenzyl)-6-keto-piperazine-2-carboxylic acid methyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CNC(C(=O)N1)CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CNC(C(=O)N1)CC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O4/c1-25-20(24)18-12-21-17(19(23)22-18)11-14-7-9-16(10-8-14)26-13-15-5-3-2-4-6-15/h2-10,17-18,21H,11-13H2,1H3,(H,22,23)