5-[(5-nitro-2-piperidin-1-yl-phenyl)carbonylamino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[(5-nitro-2-piperidin-1-yl-phenyl)carbonylamino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[[5-nitro-2-(1-piperidyl)benzoyl]amino]benzoic acid CAS Name: 2-hydroxy-5-[[[5-nitro-2-(1-piperidinyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 2-hydroxy-5-[(5-nitro-2-piperidin-1-ylbenzoyl)amino]benzoic acid Traditional Name: 2-hydroxy-5-[(5-nitro-2-piperidino-benzoyl)amino]benzoic acid Formula: C19H19N3O6 MolecularWeight: 385.37066

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)O)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C19H19N3O6/c23-17-7-4-12(10-15(17)19(25)26)20-18(24)14-11-13(22(27)28)5-6-16(14)21-8-2-1-3-9-21/h4-7,10-11,23H,1-3,8-9H2,(H,20,24)(H,25,26)