methyl 2-[1-[4-(methylamino)-3-nitro-phenyl]carbonylcyclohexyl]ethanoate

Systemtic Name: methyl 2-[1-[4-(methylamino)-3-nitro-phenyl]carbonylcyclohexyl]ethanoate Openeye Name: methyl 2-[1-[4-(methylamino)-3-nitro-benzoyl]cyclohexyl]acetate CAS Name: 2-[1-[[4-(methylamino)-3-nitrophenyl]-oxomethyl]cyclohexyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[4-(methylamino)-3-nitrobenzoyl]cyclohexyl]acetate Traditional Name: 2-[1-[4-(methylamino)-3-nitro-benzoyl]cyclohexyl]acetic acid methyl ester Formula: C17H22N2O5 MolecularWeight: 334.36698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22N2O5/c1-18-13-7-6-12(10-14(13)19(22)23)16(21)17(11-15(20)24-2)8-4-3-5-9-17/h6-7,10,18H,3-5,8-9,11H2,1-2H3