N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxidanylidene-1H-quinoline-4-carboxamide

Systemtic Name: N-[5-chloranyl-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxidanylidene-1H-quinoline-4-carboxamide Openeye Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxo-1H-quinoline-4-carboxamide CAS Name: N-[5-chloro-2-(4-methyl-1-piperazin-4-iumyl)phenyl]-2-oxo-1H-quinoline-4-carboxamide IUPAC Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-oxo-1H-quinoline-4-carboxamide Traditional Name: N-[5-chloro-2-(4-methylpiperazin-4-ium-1-yl)phenyl]-2-keto-1H-quinoline-4-carboxamide Formula: C21H22ClN4O2+ MolecularWeight: 397.87798

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=O)NC4=CC=CC=C43

Isomeric SMILES

C[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C3=CC(=O)NC4=CC=CC=C43

InChI

InChI=1S/C21H21ClN4O2/c1-25-8-10-26(11-9-25)19-7-6-14(22)12-18(19)24-21(28)16-13-20(27)23-17-5-3-2-4-15(16)17/h2-7,12-13H,8-11H2,1H3,(H,23,27)(H,24,28)/p+1