2-[4,5-diphenyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-1-ium-1-yl]ethanamide

Systemtic Name: 2-[4,5-diphenyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-1-ium-1-yl]ethanamide Openeye Name: 2-[4,5-diphenyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-1-ium-1-yl]acetamide CAS Name: 2-[4,5-diphenyl-1-[3-(1-pyrrolidinyl)propyl]-1-pyrazol-1-iumyl]acetamide IUPAC Name: 2-[4,5-diphenyl-1-(3-pyrrolidin-1-ylpropyl)pyrazol-1-ium-1-yl]acetamide Traditional Name: 2-[4,5-diphenyl-1-(3-pyrrolidinopropyl)pyrazol-1-ium-1-yl]acetamide Formula: C24H29N4O+ MolecularWeight: 389.51326

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCC[N+]2(C(=C(C=N2)C3=CC=CC=C3)C4=CC=CC=C4)CC(=O)N

Isomeric SMILES

C1CCN(C1)CCC[N+]2(C(=C(C=N2)C3=CC=CC=C3)C4=CC=CC=C4)CC(=O)N

InChI

InChI=1S/C24H28N4O/c25-23(29)19-28(17-9-16-27-14-7-8-15-27)24(21-12-5-2-6-13-21)22(18-26-28)20-10-3-1-4-11-20/h1-6,10-13,18H,7-9,14-17,19H2,(H-,25,29)/p+1