2-bromanyl-5-methoxy-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide

Systemtic Name: 2-bromanyl-5-methoxy-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Openeye Name: 2-bromo-5-methoxy-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide CAS Name: 2-bromo-5-methoxy-N-[3-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]benzamide IUPAC Name: 2-bromo-5-methoxy-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Traditional Name: 2-bromo-5-methoxy-N-[3-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]benzamide Formula: C20H25BrN3O2+ MolecularWeight: 419.3354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)OC)Br)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=C(C=CC(=C2)OC)Br)N3CC[NH+](CC3)C

InChI

InChI=1S/C20H24BrN3O2/c1-14-12-15(4-7-19(14)24-10-8-23(2)9-11-24)22-20(25)17-13-16(26-3)5-6-18(17)21/h4-7,12-13H,8-11H2,1-3H3,(H,22,25)/p+1