1,3-diphenyl-N-(3-piperidin-1-ium-1-ylpropyl)pyrazole-4-carboxamide

Systemtic Name: 1,3-diphenyl-N-(3-piperidin-1-ium-1-ylpropyl)pyrazole-4-carboxamide Openeye Name: 1,3-diphenyl-N-(3-piperidin-1-ium-1-ylpropyl)pyrazole-4-carboxamide CAS Name: 1,3-diphenyl-N-[3-(1-piperidin-1-iumyl)propyl]-4-pyrazolecarboxamide IUPAC Name: 1,3-diphenyl-N-(3-piperidin-1-ium-1-ylpropyl)pyrazole-4-carboxamide Traditional Name: 1,3-diphenyl-N-(3-piperidin-1-ium-1-ylpropyl)pyrazole-4-carboxamide Formula: C24H29N4O+ MolecularWeight: 389.51326

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCCNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC[NH+](CC1)CCCNC(=O)C2=CN(N=C2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H28N4O/c29-24(25-15-10-18-27-16-8-3-9-17-27)22-19-28(21-13-6-2-7-14-21)26-23(22)20-11-4-1-5-12-20/h1-2,4-7,11-14,19H,3,8-10,15-18H2,(H,25,29)/p+1