3-butoxy-N-[2-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]benzamide

Systemtic Name: 3-butoxy-N-[2-(4-methylpiperazin-4-ium-1-yl)carbonylphenyl]benzamide Openeye Name: 3-butoxy-N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]benzamide CAS Name: 3-butoxy-N-[2-[(4-methyl-1-piperazin-4-iumyl)-oxomethyl]phenyl]benzamide IUPAC Name: 3-butoxy-N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]benzamide Traditional Name: 3-butoxy-N-[2-(4-methylpiperazin-4-ium-1-carbonyl)phenyl]benzamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C23H29N3O3/c1-3-4-16-29-19-9-7-8-18(17-19)22(27)24-21-11-6-5-10-20(21)23(28)26-14-12-25(2)13-15-26/h5-11,17H,3-4,12-16H2,1-2H3,(H,24,27)/p+1