N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]cyclopentanecarboxamide

Systemtic Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]cyclopentanecarboxamide Openeye Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]cyclopentanecarboxamide CAS Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenyl-1-piperazin-1-iumyl)ethyl]cyclopentanecarboxamide IUPAC Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]cyclopentanecarboxamide Traditional Name: N-[(2R)-2-(4-dimethylaminophenyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethyl]cyclopentanecarboxamide Formula: C26H37N4O+ MolecularWeight: 421.59818

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(CNC(=O)C2CCCC2)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)[C@H](CNC(=O)C2CCCC2)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H36N4O/c1-28(2)23-14-12-21(13-15-23)25(20-27-26(31)22-8-6-7-9-22)30-18-16-29(17-19-30)24-10-4-3-5-11-24/h3-5,10-15,22,25H,6-9,16-20H2,1-2H3,(H,27,31)/p+1/t25-/m0/s1