N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-yl-ethyl]cyclopropanecarboxamide

Systemtic Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-yl-ethyl]cyclopropanecarboxamide Openeye Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-(3-pyridyl)ethyl]cyclopropanecarboxamide CAS Name: N-[2-(4-phenyl-1-piperazin-1-iumyl)-2-(3-pyridinyl)ethyl]cyclopropanecarboxamide IUPAC Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-pyridin-3-ylethyl]cyclopropanecarboxamide Traditional Name: N-[2-(4-phenylpiperazin-1-ium-1-yl)-2-(3-pyridyl)ethyl]cyclopropanecarboxamide Formula: C21H27N4O+ MolecularWeight: 351.46528

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NCC(C2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1CC1C(=O)NCC(C2=CN=CC=C2)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C21H26N4O/c26-21(17-8-9-17)23-16-20(18-5-4-10-22-15-18)25-13-11-24(12-14-25)19-6-2-1-3-7-19/h1-7,10,15,17,20H,8-9,11-14,16H2,(H,23,26)/p+1