2-[4-(3-nitrophenyl)piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-(3-nitrophenyl)piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-(3-nitrophenyl)piperazin-1-yl]acetic acid CAS Name: 2-[4-(3-nitrophenyl)-1-piperazinyl]acetic acid IUPAC Name: 2-[4-(3-nitrophenyl)piperazin-1-yl]acetic acid Traditional Name: 2-[4-(3-nitrophenyl)piperazino]acetic acid Formula: C12H15N3O4 MolecularWeight: 265.2652

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC(=O)O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C12H15N3O4/c16-12(17)9-13-4-6-14(7-5-13)10-2-1-3-11(8-10)15(18)19/h1-3,8H,4-7,9H2,(H,16,17)