3-methyl-N-[2-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide

Systemtic Name: 3-methyl-N-[2-[1-(phenylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide Openeye Name: N-[2-(1-benzylpiperidin-1-ium-4-yl)pyrazol-3-yl]-3-methyl-butanamide CAS Name: 3-methyl-N-[2-[1-(phenylmethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]butanamide IUPAC Name: N-[2-(1-benzylpiperidin-1-ium-4-yl)pyrazol-3-yl]-3-methylbutanamide Traditional Name: N-[2-(1-benzylpiperidin-1-ium-4-yl)pyrazol-3-yl]-3-methyl-butyramide Formula: C20H29N4O+ MolecularWeight: 341.47046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=NN1C2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)CC(=O)NC1=CC=NN1C2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C20H28N4O/c1-16(2)14-20(25)22-19-8-11-21-24(19)18-9-12-23(13-10-18)15-17-6-4-3-5-7-17/h3-8,11,16,18H,9-10,12-15H2,1-2H3,(H,22,25)/p+1