ethyl 4-(2-ethoxy-5-propan-2-yl-phenyl)sulfonyloxy-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate

Systemtic Name: ethyl 4-(2-ethoxy-5-propan-2-yl-phenyl)sulfonyloxy-1-(4-methylphenyl)-6-oxidanylidene-pyridazine-3-carboxylate Openeye Name: ethyl 4-(2-ethoxy-5-isopropyl-phenyl)sulfonyloxy-6-oxo-1-(p-tolyl)pyridazine-3-carboxylate CAS Name: 4-(2-ethoxy-5-propan-2-ylphenyl)sulfonyloxy-1-(4-methylphenyl)-6-oxo-3-pyridazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-ethoxy-5-propan-2-ylphenyl)sulfonyloxy-1-(4-methylphenyl)-6-oxopyridazine-3-carboxylate Traditional Name: 4-(2-ethoxy-5-isopropyl-phenyl)sulfonyloxy-6-keto-1-(p-tolyl)pyridazine-3-carboxylic acid ethyl ester Formula: C25H28N2O7S MolecularWeight: 500.56402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)C)S(=O)(=O)OC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)C)S(=O)(=O)OC2=CC(=O)N(N=C2C(=O)OCC)C3=CC=C(C=C3)C

InChI

InChI=1S/C25H28N2O7S/c1-6-32-20-13-10-18(16(3)4)14-22(20)35(30,31)34-21-15-23(28)27(19-11-8-17(5)9-12-19)26-24(21)25(29)33-7-2/h8-16H,6-7H2,1-5H3