2-[4-[(3-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-methylpropyl)ethanamide

Systemtic Name: 2-[4-[(3-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-methylpropyl)ethanamide Openeye Name: N-isobutyl-2-[4-(m-tolylmethyl)piperazine-1,4-diium-1-yl]acetamide CAS Name: 2-[4-[(3-methylphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2-methylpropyl)acetamide IUPAC Name: 2-[4-[(3-methylphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-methylpropyl)acetamide Traditional Name: N-isobutyl-2-[4-(3-methylbenzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C18H31N3O+2 MolecularWeight: 305.45824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C[NH+]2CC[NH+](CC2)CC(=O)NCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)C[NH+]2CC[NH+](CC2)CC(=O)NCC(C)C

InChI

InChI=1S/C18H29N3O/c1-15(2)12-19-18(22)14-21-9-7-20(8-10-21)13-17-6-4-5-16(3)11-17/h4-6,11,15H,7-10,12-14H2,1-3H3,(H,19,22)/p+2