1-[[(4-nitrophenyl)carbonylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[[(4-nitrophenyl)carbonylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[[(4-nitrobenzoyl)amino]methyl]cyclohexanecarboxylic acid CAS Name: 1-[[[(4-nitrophenyl)-oxomethyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[[(4-nitrobenzoyl)amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 1-[[(4-nitrobenzoyl)amino]methyl]cyclohexanecarboxylic acid Formula: C15H18N2O5 MolecularWeight: 306.31382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CCC(CC1)(CNC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C15H18N2O5/c18-13(11-4-6-12(7-5-11)17(21)22)16-10-15(14(19)20)8-2-1-3-9-15/h4-7H,1-3,8-10H2,(H,16,18)(H,19,20)