[2-acetamido-3-(4-nitrophenyl)-3-oxidanyl-propyl] cyclohexanecarboxylate

Systemtic Name: [2-acetamido-3-(4-nitrophenyl)-3-oxidanyl-propyl] cyclohexanecarboxylate Openeye Name: [2-acetamido-3-hydroxy-3-(4-nitrophenyl)propyl] cyclohexanecarboxylate CAS Name: cyclohexanecarboxylic acid [2-acetamido-3-hydroxy-3-(4-nitrophenyl)propyl] ester IUPAC Name: [2-acetamido-3-hydroxy-3-(4-nitrophenyl)propyl] cyclohexanecarboxylate Traditional Name: cyclohexanecarboxylic acid [2-acetamido-3-hydroxy-3-(4-nitrophenyl)propyl] ester Formula: C18H24N2O6 MolecularWeight: 364.39296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(COC(=O)C1CCCCC1)C(C2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CC(=O)NC(COC(=O)C1CCCCC1)C(C2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H24N2O6/c1-12(21)19-16(11-26-18(23)14-5-3-2-4-6-14)17(22)13-7-9-15(10-8-13)20(24)25/h7-10,14,16-17,22H,2-6,11H2,1H3,(H,19,21)