6-bromanyl-2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1H-quinolin-4-one

Systemtic Name: 6-bromanyl-2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1H-quinolin-4-one Openeye Name: 6-bromo-2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1H-quinolin-4-one CAS Name: 6-bromo-2-methyl-3-[(4-methyl-1-piperazine-1,4-diiumyl)methyl]-1H-quinolin-4-one IUPAC Name: 6-bromo-2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-1H-quinolin-4-one Traditional Name: 6-bromo-2-methyl-3-[(4-methylpiperazine-1,4-diium-1-yl)methyl]-4-quinolone Formula: C16H22BrN3O+2 MolecularWeight: 352.26938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(N1)C=CC(=C2)Br)C[NH+]3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C(=O)C2=C(N1)C=CC(=C2)Br)C[NH+]3CC[NH+](CC3)C

InChI

InChI=1S/C16H20BrN3O/c1-11-14(10-20-7-5-19(2)6-8-20)16(21)13-9-12(17)3-4-15(13)18-11/h3-4,9H,5-8,10H2,1-2H3,(H,18,21)/p+2