2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(2R)-4-phenylbutan-2-yl]ethanamide

Systemtic Name: 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(2R)-4-phenylbutan-2-yl]ethanamide Openeye Name: N-[(1R)-1-methyl-3-phenyl-propyl]-2-[4-(o-tolylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: 2-[4-[(2-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-[(2R)-4-phenylbutan-2-yl]acetamide IUPAC Name: 2-[4-[(2-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-[(2R)-4-phenylbutan-2-yl]acetamide Traditional Name: 2-[4-(2-methylbenzyl)piperazine-1,4-diium-1-yl]-N-[(1R)-1-methyl-3-phenyl-propyl]acetamide Formula: C24H35N3O+2 MolecularWeight: 381.5542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)NC(C)CCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1C[NH+]2CC[NH+](CC2)CC(=O)N[C@H](C)CCC3=CC=CC=C3

InChI

InChI=1S/C24H33N3O/c1-20-8-6-7-11-23(20)18-26-14-16-27(17-15-26)19-24(28)25-21(2)12-13-22-9-4-3-5-10-22/h3-11,21H,12-19H2,1-2H3,(H,25,28)/p+2/t21-/m1/s1