2-(3-nitro-4-piperidin-1-yl-phenyl)carbonylbenzoic acid

Systemtic Name: 2-(3-nitro-4-piperidin-1-yl-phenyl)carbonylbenzoic acid Openeye Name: 2-[3-nitro-4-(1-piperidyl)benzoyl]benzoic acid CAS Name: 2-[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]benzoic acid IUPAC Name: 2-(3-nitro-4-piperidin-1-ylbenzoyl)benzoic acid Traditional Name: 2-(3-nitro-4-piperidino-benzoyl)benzoic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(=O)C3=CC=CC=C3C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O5/c22-18(14-6-2-3-7-15(14)19(23)24)13-8-9-16(17(12-13)21(25)26)20-10-4-1-5-11-20/h2-3,6-9,12H,1,4-5,10-11H2,(H,23,24)