3-bromanyl-2,5-dimethoxy-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 3-bromanyl-2,5-dimethoxy-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]benzamide Openeye Name: 3-bromo-2,5-dimethoxy-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]benzamide CAS Name: 3-bromo-2,5-dimethoxy-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]benzamide IUPAC Name: 3-bromo-2,5-dimethoxy-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]benzamide Traditional Name: 3-bromo-2,5-dimethoxy-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]benzamide Formula: C19H24BrN4O3+ MolecularWeight: 436.32286

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=CC(=C3OC)Br)OC

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=C(C=C2)NC(=O)C3=CC(=CC(=C3OC)Br)OC

InChI

InChI=1S/C19H23BrN4O3/c1-23-6-8-24(9-7-23)17-5-4-13(12-21-17)22-19(25)15-10-14(26-2)11-16(20)18(15)27-3/h4-5,10-12H,6-9H2,1-3H3,(H,22,25)/p+1