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2-[1-[4-(methylamino)-3-nitro-phenyl]carbonylcyclohexyl]ethanoic acid

2-[1-[4-(methylamino)-3-nitro-phenyl]carbonylcyclohexyl]ethanoic acid

Systemtic Name:2-[1-[4-(methylamino)-3-nitro-phenyl]carbonylcyclohexyl]ethanoic acid
Openeye Name:2-[1-[4-(methylamino)-3-nitro-benzoyl]cyclohexyl]acetic acid
CAS Name:2-[1-[[4-(methylamino)-3-nitrophenyl]-oxomethyl]cyclohexyl]acetic acid
IUPAC Name:2-[1-[4-(methylamino)-3-nitrobenzoyl]cyclohexyl]acetic acid
Traditional Name:2-[1-[4-(methylamino)-3-nitro-benzoyl]cyclohexyl]acetic acid
Formula: C16H20N2O5
MolecularWeight: 320.3404
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C16H20N2O5/c1-17-12-6-5-11(9-13(12)18(22)23)15(21)16(10-14(19)20)7-3-2-4-8-16/h5-6,9,17H,2-4,7-8,10H2,1H3,(H,19,20)


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