1-[(3-methoxyphenyl)methyl]-4-phenylmethoxycarbonyl-piperazine-2-carboxylic acid

Systemtic Name: 1-[(3-methoxyphenyl)methyl]-4-phenylmethoxycarbonyl-piperazine-2-carboxylic acid Openeye Name: 4-benzyloxycarbonyl-1-[(3-methoxyphenyl)methyl]piperazine-2-carboxylic acid CAS Name: 1-[(3-methoxyphenyl)methyl]-4-phenylmethoxycarbonyl-2-piperazinecarboxylic acid IUPAC Name: 1-[(3-methoxyphenyl)methyl]-4-phenylmethoxycarbonylpiperazine-2-carboxylic acid Traditional Name: 4-carbobenzoxy-1-m-anisyl-piperazine-2-carboxylic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCN(CC2C(=O)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCN(CC2C(=O)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O5/c1-27-18-9-5-8-17(12-18)13-22-10-11-23(14-19(22)20(24)25)21(26)28-15-16-6-3-2-4-7-16/h2-9,12,19H,10-11,13-15H2,1H3,(H,24,25)