methyl 1-[[1-(3-nitrophenyl)pyrazol-3-yl]carbonylamino]cyclohexane-1-carboxylate

Systemtic Name: methyl 1-[[1-(3-nitrophenyl)pyrazol-3-yl]carbonylamino]cyclohexane-1-carboxylate Openeye Name: methyl 1-[[1-(3-nitrophenyl)pyrazole-3-carbonyl]amino]cyclohexanecarboxylate CAS Name: 1-[[[1-(3-nitrophenyl)-3-pyrazolyl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-[[1-(3-nitrophenyl)pyrazole-3-carbonyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[1-(3-nitrophenyl)pyrazole-3-carbonyl]amino]cyclohexanecarboxylic acid methyl ester Formula: C18H20N4O5 MolecularWeight: 372.3752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=NN(C=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O5/c1-27-17(24)18(9-3-2-4-10-18)19-16(23)15-8-11-21(20-15)13-6-5-7-14(12-13)22(25)26/h5-8,11-12H,2-4,9-10H2,1H3,(H,19,23)