6-bromanyl-2-(5-methylfuran-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(5-methylfuran-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)quinoline-4-carboxamide Openeye Name: 6-bromo-2-(5-methyl-2-furyl)-N-(4-methylpiperazin-4-ium-1-yl)quinoline-4-carboxamide CAS Name: 6-bromo-2-(5-methyl-2-furanyl)-N-(4-methyl-1-piperazin-4-iumyl)-4-quinolinecarboxamide IUPAC Name: 6-bromo-2-(5-methylfuran-2-yl)-N-(4-methylpiperazin-4-ium-1-yl)quinoline-4-carboxamide Traditional Name: 6-bromo-2-(5-methyl-2-furyl)-N-(4-methylpiperazin-4-ium-1-yl)cinchoninamide Formula: C20H22BrN4O2+ MolecularWeight: 430.31828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NN4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(O1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NN4CC[NH+](CC4)C

InChI

InChI=1S/C20H21BrN4O2/c1-13-3-6-19(27-13)18-12-16(15-11-14(21)4-5-17(15)22-18)20(26)23-25-9-7-24(2)8-10-25/h3-6,11-12H,7-10H2,1-2H3,(H,23,26)/p+1