2-[4-(4-nitrophenyl)piperazin-1-yl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[4-(4-nitrophenyl)piperazin-1-yl]-2-phenyl-ethanoic acid Openeye Name: 2-[4-(4-nitrophenyl)piperazin-1-yl]-2-phenyl-acetic acid CAS Name: 2-[4-(4-nitrophenyl)-1-piperazinyl]-2-phenylacetic acid IUPAC Name: 2-[4-(4-nitrophenyl)piperazin-1-yl]-2-phenylacetic acid Traditional Name: 2-[4-(4-nitrophenyl)piperazino]-2-phenyl-acetic acid Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)[N+](=O)[O-])C(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H19N3O4/c22-18(23)17(14-4-2-1-3-5-14)20-12-10-19(11-13-20)15-6-8-16(9-7-15)21(24)25/h1-9,17H,10-13H2,(H,22,23)