6-chloranyl-2-methyl-3-[(4-methylpiperazin-1-ium-1-yl)methyl]quinolin-4-olate

Systemtic Name: 6-chloranyl-2-methyl-3-[(4-methylpiperazin-1-ium-1-yl)methyl]quinolin-4-olate Openeye Name: 6-chloro-2-methyl-3-[(4-methylpiperazin-1-ium-1-yl)methyl]quinolin-4-olate CAS Name: 6-chloro-2-methyl-3-[(4-methyl-1-piperazin-1-iumyl)methyl]-4-quinolinolate IUPAC Name: 6-chloro-2-methyl-3-[(4-methylpiperazin-1-ium-1-yl)methyl]quinolin-4-olate Traditional Name: 6-chloro-2-methyl-3-[(4-methylpiperazin-1-ium-1-yl)methyl]quinolin-4-olate Formula: C16H20ClN3O MolecularWeight: 305.8025

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Cl)C(=C1C[NH+]3CCN(CC3)C)[O-]

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Cl)C(=C1C[NH+]3CCN(CC3)C)[O-]

InChI

InChI=1S/C16H20ClN3O/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)