N-[(2R)-2-(4-methylphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]cyclopentanecarboxamide

Systemtic Name: N-[(2R)-2-(4-methylphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]cyclopentanecarboxamide Openeye Name: N-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-2-(p-tolyl)ethyl]cyclopentanecarboxamide CAS Name: N-[(2R)-2-(4-methylphenyl)-2-(4-methyl-1-piperazine-1,4-diiumyl)ethyl]cyclopentanecarboxamide IUPAC Name: N-[(2R)-2-(4-methylphenyl)-2-(4-methylpiperazine-1,4-diium-1-yl)ethyl]cyclopentanecarboxamide Traditional Name: N-[(2R)-2-(4-methylpiperazine-1,4-diium-1-yl)-2-(p-tolyl)ethyl]cyclopentanecarboxamide Formula: C20H33N3O+2 MolecularWeight: 331.49552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CNC(=O)C2CCCC2)[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](CNC(=O)C2CCCC2)[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C20H31N3O/c1-16-7-9-17(10-8-16)19(23-13-11-22(2)12-14-23)15-21-20(24)18-5-3-4-6-18/h7-10,18-19H,3-6,11-15H2,1-2H3,(H,21,24)/p+2/t19-/m0/s1