1-[4-(methylamino)-3-nitro-phenyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[4-(methylamino)-3-nitro-phenyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[4-(methylamino)-3-nitro-phenyl]cyclohexanecarboxylic acid CAS Name: 1-[4-(methylamino)-3-nitrophenyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[4-(methylamino)-3-nitrophenyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[4-(methylamino)-3-nitro-phenyl]cyclohexanecarboxylic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C2(CCCCC2)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C2(CCCCC2)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C14H18N2O4/c1-15-11-6-5-10(9-12(11)16(19)20)14(13(17)18)7-3-2-4-8-14/h5-6,9,15H,2-4,7-8H2,1H3,(H,17,18)