N-cyclopropyl-3-[1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]propanamide

Systemtic Name: N-cyclopropyl-3-[1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]propanamide Openeye Name: N-cyclopropyl-3-[1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]propanamide CAS Name: N-cyclopropyl-3-[1-[[1-(2-methoxyphenyl)-4-pyrazolyl]methyl]-4-piperidin-1-iumyl]propanamide IUPAC Name: N-cyclopropyl-3-[1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]propanamide Traditional Name: N-cyclopropyl-3-[1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]piperidin-1-ium-4-yl]propionamide Formula: C22H31N4O2+ MolecularWeight: 383.50714

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=C(C=N2)C[NH+]3CCC(CC3)CCC(=O)NC4CC4

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C=N2)C[NH+]3CCC(CC3)CCC(=O)NC4CC4

InChI

InChI=1S/C22H30N4O2/c1-28-21-5-3-2-4-20(21)26-16-18(14-23-26)15-25-12-10-17(11-13-25)6-9-22(27)24-19-7-8-19/h2-5,14,16-17,19H,6-13,15H2,1H3,(H,24,27)/p+1