5-bromanyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]furan-2-carboxamide CAS Name: 5-bromo-N-[2-methyl-4-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[2-methyl-4-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-furamide Formula: C17H21BrN3O2+ MolecularWeight: 379.27154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC=C(O3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)C)NC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C17H20BrN3O2/c1-12-11-13(21-9-7-20(2)8-10-21)3-4-14(12)19-17(22)15-5-6-16(18)23-15/h3-6,11H,7-10H2,1-2H3,(H,19,22)/p+1