(2R)-N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazine-1,4-diium-1-yl)pentanamide

Systemtic Name: (2R)-N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazine-1,4-diium-1-yl)pentanamide Openeye Name: (2R)-N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazine-1,4-diium-1-yl)pentanamide CAS Name: (2R)-N-(4-cyclopentylphenyl)-4-methyl-2-(4-methyl-1-piperazine-1,4-diiumyl)pentanamide IUPAC Name: (2R)-N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazine-1,4-diium-1-yl)pentanamide Traditional Name: (2R)-N-(4-cyclopentylphenyl)-4-methyl-2-(4-methylpiperazine-1,4-diium-1-yl)valeramide Formula: C22H37N3O+2 MolecularWeight: 359.54868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1=CC=C(C=C1)C2CCCC2)[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CC(C)C[C@H](C(=O)NC1=CC=C(C=C1)C2CCCC2)[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C22H35N3O/c1-17(2)16-21(25-14-12-24(3)13-15-25)22(26)23-20-10-8-19(9-11-20)18-6-4-5-7-18/h8-11,17-18,21H,4-7,12-16H2,1-3H3,(H,23,26)/p+2/t21-/m1/s1