2-[2-[4-(methylamino)-3-nitro-phenyl]cyclohexyl]ethanoic acid

Systemtic Name: 2-[2-[4-(methylamino)-3-nitro-phenyl]cyclohexyl]ethanoic acid Openeye Name: 2-[2-[4-(methylamino)-3-nitro-phenyl]cyclohexyl]acetic acid CAS Name: 2-[2-[4-(methylamino)-3-nitrophenyl]cyclohexyl]acetic acid IUPAC Name: 2-[2-[4-(methylamino)-3-nitrophenyl]cyclohexyl]acetic acid Traditional Name: 2-[2-[4-(methylamino)-3-nitro-phenyl]cyclohexyl]acetic acid Formula: C15H20N2O4 MolecularWeight: 292.3303

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C2CCCCC2CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C2CCCCC2CC(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C15H20N2O4/c1-16-13-7-6-11(8-14(13)17(20)21)12-5-3-2-4-10(12)9-15(18)19/h6-8,10,12,16H,2-5,9H2,1H3,(H,18,19)