N-[2-(1-cyclopentylpiperidin-1-ium-4-yl)pyrazol-3-yl]-4-phenyl-butanamide

Systemtic Name: N-[2-(1-cyclopentylpiperidin-1-ium-4-yl)pyrazol-3-yl]-4-phenyl-butanamide Openeye Name: N-[2-(1-cyclopentylpiperidin-1-ium-4-yl)pyrazol-3-yl]-4-phenyl-butanamide CAS Name: N-[2-(1-cyclopentyl-4-piperidin-1-iumyl)-3-pyrazolyl]-4-phenylbutanamide IUPAC Name: N-[2-(1-cyclopentylpiperidin-1-ium-4-yl)pyrazol-3-yl]-4-phenylbutanamide Traditional Name: N-[2-(1-cyclopentylpiperidin-1-ium-4-yl)pyrazol-3-yl]-4-phenyl-butyramide Formula: C23H33N4O+ MolecularWeight: 381.53432

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CCCC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)[NH+]2CCC(CC2)N3C(=CC=N3)NC(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C23H32N4O/c28-23(12-6-9-19-7-2-1-3-8-19)25-22-13-16-24-27(22)21-14-17-26(18-15-21)20-10-4-5-11-20/h1-3,7-8,13,16,20-21H,4-6,9-12,14-15,17-18H2,(H,25,28)/p+1