3-methoxy-4-(3-methylbutoxy)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]benzamide

Systemtic Name: 3-methoxy-4-(3-methylbutoxy)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]benzamide Openeye Name: 4-isopentyloxy-3-methoxy-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]benzamide CAS Name: 3-methoxy-4-(3-methylbutoxy)-N-[6-(4-methyl-1-piperazin-4-iumyl)-3-pyridinyl]benzamide IUPAC Name: 3-methoxy-4-(3-methylbutoxy)-N-[6-(4-methylpiperazin-4-ium-1-yl)pyridin-3-yl]benzamide Traditional Name: 4-isoamoxy-3-methoxy-N-[6-(4-methylpiperazin-4-ium-1-yl)-3-pyridyl]benzamide Formula: C23H33N4O3+ MolecularWeight: 413.53312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)OC

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)C(=O)NC2=CN=C(C=C2)N3CC[NH+](CC3)C)OC

InChI

InChI=1S/C23H32N4O3/c1-17(2)9-14-30-20-7-5-18(15-21(20)29-4)23(28)25-19-6-8-22(24-16-19)27-12-10-26(3)11-13-27/h5-8,15-17H,9-14H2,1-4H3,(H,25,28)/p+1