3,4-dimethyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide

Systemtic Name: 3,4-dimethyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Openeye Name: 3,4-dimethyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide CAS Name: 3,4-dimethyl-N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 3,4-dimethyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Traditional Name: 3,4-dimethyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C21H28N3O+ MolecularWeight: 338.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)N3CC[NH+](CC3)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=C(C=C(C=C2)N3CC[NH+](CC3)C)C)C

InChI

InChI=1S/C21H27N3O/c1-15-5-6-18(13-16(15)2)21(25)22-20-8-7-19(14-17(20)3)24-11-9-23(4)10-12-24/h5-8,13-14H,9-12H2,1-4H3,(H,22,25)/p+1