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N-[2-(1-cyclohexylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide

N-[2-(1-cyclohexylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide

Systemtic Name:N-[2-(1-cyclohexylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide
Openeye Name:N-[2-(1-cyclohexylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide
CAS Name:N-[2-(1-cyclohexyl-4-piperidin-1-iumyl)-3-pyrazolyl]benzamide
IUPAC Name:N-[2-(1-cyclohexylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide
Traditional Name:N-[2-(1-cyclohexylpiperidin-1-ium-4-yl)pyrazol-3-yl]benzamide
Formula: C21H29N4O+
MolecularWeight: 353.48116
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4


Isomeric SMILES

C1CCC(CC1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4


InChI

InChI=1S/C21H28N4O/c26-21(17-7-3-1-4-8-17)23-20-11-14-22-25(20)19-12-15-24(16-13-19)18-9-5-2-6-10-18/h1,3-4,7-8,11,14,18-19H,2,5-6,9-10,12-13,15-16H2,(H,23,26)/p+1


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