2-methyl-N-[2-[1-[(3-methylphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide

Systemtic Name: 2-methyl-N-[2-[1-[(3-methylphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Openeye Name: 2-methyl-N-[2-[1-(m-tolylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide CAS Name: 2-methyl-N-[2-[1-[(3-methylphenyl)methyl]-4-piperidin-1-iumyl]-3-pyrazolyl]benzamide IUPAC Name: 2-methyl-N-[2-[1-[(3-methylphenyl)methyl]piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Traditional Name: 2-methyl-N-[2-[1-(3-methylbenzyl)piperidin-1-ium-4-yl]pyrazol-3-yl]benzamide Formula: C24H29N4O+ MolecularWeight: 389.51326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4C

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)C4=CC=CC=C4C

InChI

InChI=1S/C24H28N4O/c1-18-6-5-8-20(16-18)17-27-14-11-21(12-15-27)28-23(10-13-25-28)26-24(29)22-9-4-3-7-19(22)2/h3-10,13,16,21H,11-12,14-15,17H2,1-2H3,(H,26,29)/p+1