3-(2-methoxyphenyl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1-phenyl-pyrazole-4-carboxamide

Systemtic Name: 3-(2-methoxyphenyl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1-phenyl-pyrazole-4-carboxamide Openeye Name: 3-(2-methoxyphenyl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1-phenyl-pyrazole-4-carboxamide CAS Name: 3-(2-methoxyphenyl)-N-[[1-(4-morpholin-4-iumyl)cyclohexyl]methyl]-1-phenyl-4-pyrazolecarboxamide IUPAC Name: 3-(2-methoxyphenyl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1-phenylpyrazole-4-carboxamide Traditional Name: 3-(2-methoxyphenyl)-N-[(1-morpholin-4-ium-4-ylcyclohexyl)methyl]-1-phenyl-pyrazole-4-carboxamide Formula: C28H35N4O3+ MolecularWeight: 475.6025

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C=C2C(=O)NCC3(CCCCC3)[NH+]4CCOCC4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C=C2C(=O)NCC3(CCCCC3)[NH+]4CCOCC4)C5=CC=CC=C5

InChI

InChI=1S/C28H34N4O3/c1-34-25-13-7-6-12-23(25)26-24(20-32(30-26)22-10-4-2-5-11-22)27(33)29-21-28(14-8-3-9-15-28)31-16-18-35-19-17-31/h2,4-7,10-13,20H,3,8-9,14-19,21H2,1H3,(H,29,33)/p+1