N-[3-[4-(4-methylpiperazin-1-ium-1-yl)piperidin-1-yl]phenyl]-4-phenyl-butanamide

Systemtic Name: N-[3-[4-(4-methylpiperazin-1-ium-1-yl)piperidin-1-yl]phenyl]-4-phenyl-butanamide Openeye Name: N-[3-[4-(4-methylpiperazin-1-ium-1-yl)-1-piperidyl]phenyl]-4-phenyl-butanamide CAS Name: N-[3-[4-(4-methyl-1-piperazin-1-iumyl)-1-piperidinyl]phenyl]-4-phenylbutanamide IUPAC Name: N-[3-[4-(4-methylpiperazin-1-ium-1-yl)piperidin-1-yl]phenyl]-4-phenylbutanamide Traditional Name: N-[3-[4-(4-methylpiperazin-1-ium-1-yl)piperidino]phenyl]-4-phenyl-butyramide Formula: C26H37N4O+ MolecularWeight: 421.59818

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[NH+](CC1)C2CCN(CC2)C3=CC(=CC=C3)NC(=O)CCCC4=CC=CC=C4

Isomeric SMILES

CN1CC[NH+](CC1)C2CCN(CC2)C3=CC(=CC=C3)NC(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C26H36N4O/c1-28-17-19-30(20-18-28)24-13-15-29(16-14-24)25-11-6-10-23(21-25)27-26(31)12-5-9-22-7-3-2-4-8-22/h2-4,6-8,10-11,21,24H,5,9,12-20H2,1H3,(H,27,31)/p+1