4-phenyl-N-[2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide

Systemtic Name: 4-phenyl-N-[2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide Openeye Name: 4-phenyl-N-[2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide CAS Name: 4-phenyl-N-[2-[1-(2-pyridinylmethyl)-4-piperidin-1-iumyl]-3-pyrazolyl]butanamide IUPAC Name: 4-phenyl-N-[2-[1-(pyridin-2-ylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]butanamide Traditional Name: 4-phenyl-N-[2-[1-(2-pyridylmethyl)piperidin-1-ium-4-yl]pyrazol-3-yl]butyramide Formula: C24H30N5O+ MolecularWeight: 404.5279

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)CCCC3=CC=CC=C3)CC4=CC=CC=N4

Isomeric SMILES

C1C[NH+](CCC1N2C(=CC=N2)NC(=O)CCCC3=CC=CC=C3)CC4=CC=CC=N4

InChI

InChI=1S/C24H29N5O/c30-24(11-6-9-20-7-2-1-3-8-20)27-23-12-16-26-29(23)22-13-17-28(18-14-22)19-21-10-4-5-15-25-21/h1-5,7-8,10,12,15-16,22H,6,9,11,13-14,17-19H2,(H,27,30)/p+1