4-(2-nitrophenyl)-1-phenylmethoxycarbonyl-piperazine-2-carboxylic acid

Systemtic Name: 4-(2-nitrophenyl)-1-phenylmethoxycarbonyl-piperazine-2-carboxylic acid Openeye Name: 1-benzyloxycarbonyl-4-(2-nitrophenyl)piperazine-2-carboxylic acid CAS Name: 4-(2-nitrophenyl)-1-phenylmethoxycarbonyl-2-piperazinecarboxylic acid IUPAC Name: 4-(2-nitrophenyl)-1-phenylmethoxycarbonylpiperazine-2-carboxylic acid Traditional Name: 1-carbobenzoxy-4-(2-nitrophenyl)piperazine-2-carboxylic acid Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1C2=CC=CC=C2[N+](=O)[O-])C(=O)O)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1CN(C(CN1C2=CC=CC=C2[N+](=O)[O-])C(=O)O)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O6/c23-18(24)17-12-20(15-8-4-5-9-16(15)22(26)27)10-11-21(17)19(25)28-13-14-6-2-1-3-7-14/h1-9,17H,10-13H2,(H,23,24)