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

Systemtic Name: N-(2-methylpropyl)-2-[4-[(4-propan-2-ylphenyl)methyl]piperazine-1,4-diium-1-yl]ethanamide Openeye Name: N-isobutyl-2-[4-[(4-isopropylphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide CAS Name: N-(2-methylpropyl)-2-[4-[(4-propan-2-ylphenyl)methyl]-1-piperazine-1,4-diiumyl]acetamide IUPAC Name: N-(2-methylpropyl)-2-[4-[(4-propan-2-ylphenyl)methyl]piperazine-1,4-diium-1-yl]acetamide Traditional Name: N-isobutyl-2-[4-(4-isopropylbenzyl)piperazine-1,4-diium-1-yl]acetamide Formula: C20H35N3O+2 MolecularWeight: 333.5114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC(C)CNC(=O)C[NH+]1CC[NH+](CC1)CC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C20H33N3O/c1-16(2)13-21-20(24)15-23-11-9-22(10-12-23)14-18-5-7-19(8-6-18)17(3)4/h5-8,16-17H,9-15H2,1-4H3,(H,21,24)/p+2