N-(2-methylpropyl)-4-(piperazin-4-ium-1-ylmethyl)benzamide

Systemtic Name: N-(2-methylpropyl)-4-(piperazin-4-ium-1-ylmethyl)benzamide Openeye Name: N-isobutyl-4-(piperazin-4-ium-1-ylmethyl)benzamide CAS Name: N-(2-methylpropyl)-4-(1-piperazin-4-iumylmethyl)benzamide IUPAC Name: N-(2-methylpropyl)-4-(piperazin-4-ium-1-ylmethyl)benzamide Traditional Name: N-isobutyl-4-(piperazin-4-ium-1-ylmethyl)benzamide Formula: C16H26N3O+ MolecularWeight: 276.39714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CC=C(C=C1)CN2CC[NH2+]CC2

Isomeric SMILES

CC(C)CNC(=O)C1=CC=C(C=C1)CN2CC[NH2+]CC2

InChI

InChI=1S/C16H25N3O/c1-13(2)11-18-16(20)15-5-3-14(4-6-15)12-19-9-7-17-8-10-19/h3-6,13,17H,7-12H2,1-2H3,(H,18,20)/p+1