[4-[[(7-chloranylquinolin-4-yl)hydrazinylidene]methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate

Systemtic Name: [4-[[(7-chloranylquinolin-4-yl)hydrazinylidene]methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate Openeye Name: [4-[[(7-chloro-4-quinolyl)hydrazono]methyl]-2-methoxy-phenyl] 2,5-dimethylbenzenesulfonate CAS Name: 2,5-dimethylbenzenesulfonic acid [4-[[(7-chloro-4-quinolinyl)hydrazinylidene]methyl]-2-methoxyphenyl] ester IUPAC Name: [4-[[(7-chloroquinolin-4-yl)hydrazinylidene]methyl]-2-methoxyphenyl] 2,5-dimethylbenzenesulfonate Traditional Name: 2,5-dimethylbenzenesulfonic acid [4-[[(7-chloro-4-quinolyl)hydrazono]methyl]-2-methoxy-phenyl] ester Formula: C25H22ClN3O4S MolecularWeight: 495.97788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC3=C4C=CC(=CC4=NC=C3)Cl)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)OC2=C(C=C(C=C2)C=NNC3=C4C=CC(=CC4=NC=C3)Cl)OC

InChI

InChI=1S/C25H22ClN3O4S/c1-16-4-5-17(2)25(12-16)34(30,31)33-23-9-6-18(13-24(23)32-3)15-28-29-21-10-11-27-22-14-19(26)7-8-20(21)22/h4-15H,1-3H3,(H,27,29)