6-chloranyl-4-phenyl-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-quinolin-2-one

Systemtic Name: 6-chloranyl-4-phenyl-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-quinolin-2-one Openeye Name: 6-chloro-4-phenyl-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-quinolin-2-one CAS Name: 6-chloro-4-phenyl-3-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-1H-quinolin-2-one IUPAC Name: 6-chloro-4-phenyl-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-1H-quinolin-2-one Traditional Name: 6-chloro-4-phenyl-3-(4-pyridin-1-ium-2-ylpiperazino)carbostyril Formula: C24H22ClN4O+ MolecularWeight: 417.91068

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=[NH+]2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1C2=CC=CC=[NH+]2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5

InChI

InChI=1S/C24H21ClN4O/c25-18-9-10-20-19(16-18)22(17-6-2-1-3-7-17)23(24(30)27-20)29-14-12-28(13-15-29)21-8-4-5-11-26-21/h1-11,16H,12-15H2,(H,27,30)/p+1