5,7-bis(chloranyl)-2-oxidanyl-3-(4-piperidin-4-yloxyphenyl)sulfanyl-1H-quinolin-4-one hydrochloride

Systemtic Name: 5,7-bis(chloranyl)-2-oxidanyl-3-(4-piperidin-4-yloxyphenyl)sulfanyl-1H-quinolin-4-one hydrochloride Openeye Name: 5,7-dichloro-2-hydroxy-3-[4-(4-piperidyloxy)phenyl]sulfanyl-1H-quinolin-4-one hydrochloride CAS Name: 5,7-dichloro-2-hydroxy-3-[[4-(4-piperidinyloxy)phenyl]thio]-1H-quinolin-4-one hydrochloride IUPAC Name: 5,7-dichloro-2-hydroxy-3-(4-piperidin-4-yloxyphenyl)sulfanyl-1H-quinolin-4-one hydrochloride Traditional Name: 5,7-dichloro-2-hydroxy-3-[[4-(4-piperidyloxy)phenyl]thio]-4-quinolone hydrochloride Formula: C20H19Cl3N2O3S MolecularWeight: 473.80046

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1OC2=CC=C(C=C2)SC3=C(NC4=CC(=CC(=C4C3=O)Cl)Cl)O.Cl

Isomeric SMILES

C1CNCCC1OC2=CC=C(C=C2)SC3=C(NC4=CC(=CC(=C4C3=O)Cl)Cl)O.Cl

InChI

InChI=1S/C20H18Cl2N2O3S.ClH/c21-11-9-15(22)17-16(10-11)24-20(26)19(18(17)25)28-14-3-1-12(2-4-14)27-13-5-7-23-8-6-13;/h1-4,9-10,13,23H,5-8H2,(H2,24,25,26);1H