5-nitro-2-[(4-oxidanylcyclohexyl)amino]benzoic acid

Systemtic Name: 5-nitro-2-[(4-oxidanylcyclohexyl)amino]benzoic acid Openeye Name: 2-[(4-hydroxycyclohexyl)amino]-5-nitro-benzoic acid CAS Name: 2-[(4-hydroxycyclohexyl)amino]-5-nitrobenzoic acid IUPAC Name: 2-[(4-hydroxycyclohexyl)amino]-5-nitrobenzoic acid Traditional Name: 2-[(4-hydroxycyclohexyl)amino]-5-nitro-benzoic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)O

Isomeric SMILES

C1CC(CCC1NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O)O

InChI

InChI=1S/C13H16N2O5/c16-10-4-1-8(2-5-10)14-12-6-3-9(15(19)20)7-11(12)13(17)18/h3,6-8,10,14,16H,1-2,4-5H2,(H,17,18)