pyridazin-4-yl 2-chloranyl-5-(3-cyanophenoxy)-4-methyl-benzenesulfonate

Systemtic Name: pyridazin-4-yl 2-chloranyl-5-(3-cyanophenoxy)-4-methyl-benzenesulfonate Openeye Name: pyridazin-4-yl 2-chloro-5-(3-cyanophenoxy)-4-methyl-benzenesulfonate CAS Name: 2-chloro-5-(3-cyanophenoxy)-4-methylbenzenesulfonic acid 4-pyridazinyl ester IUPAC Name: pyridazin-4-yl 2-chloro-5-(3-cyanophenoxy)-4-methylbenzenesulfonate Traditional Name: 2-chloro-5-(3-cyanophenoxy)-4-methyl-benzenesulfonic acid pyridazin-4-yl ester Formula: C18H12ClN3O4S MolecularWeight: 401.82358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1OC2=CC=CC(=C2)C#N)S(=O)(=O)OC3=CN=NC=C3)Cl

Isomeric SMILES

CC1=CC(=C(C=C1OC2=CC=CC(=C2)C#N)S(=O)(=O)OC3=CN=NC=C3)Cl

InChI

InChI=1S/C18H12ClN3O4S/c1-12-7-16(19)18(27(23,24)26-15-5-6-21-22-11-15)9-17(12)25-14-4-2-3-13(8-14)10-20/h2-9,11H,1H3