4-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzamide

Systemtic Name: 4-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzamide Openeye Name: 4-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzamide CAS Name: 4-[[4-(2,3-dimethylphenyl)-1-piperazin-1-iumyl]methyl]benzamide IUPAC Name: 4-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzamide Traditional Name: 4-[[4-(2,3-dimethylphenyl)piperazin-1-ium-1-yl]methyl]benzamide Formula: C20H26N3O+ MolecularWeight: 324.43994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)C(=O)N)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CC[NH+](CC2)CC3=CC=C(C=C3)C(=O)N)C

InChI

InChI=1S/C20H25N3O/c1-15-4-3-5-19(16(15)2)23-12-10-22(11-13-23)14-17-6-8-18(9-7-17)20(21)24/h3-9H,10-14H2,1-2H3,(H2,21,24)/p+1