ethyl 6-chloranyl-7-methyl-4-(2-methylphenyl)-2-oxidanylidene-thiochromene-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-7-methyl-4-(2-methylphenyl)-2-oxidanylidene-thiochromene-3-carboxylate Openeye Name: ethyl 6-chloro-7-methyl-4-(o-tolyl)-2-oxo-thiochromene-3-carboxylate CAS Name: 6-chloro-7-methyl-4-(2-methylphenyl)-2-oxo-1-benzothiopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-7-methyl-4-(2-methylphenyl)-2-oxothiochromene-3-carboxylate Traditional Name: 6-chloro-2-keto-7-methyl-4-(o-tolyl)thiochromene-3-carboxylic acid ethyl ester Formula: C20H17ClO3S MolecularWeight: 372.86518

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2SC1=O)C)Cl)C3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2SC1=O)C)Cl)C3=CC=CC=C3C

InChI

InChI=1S/C20H17ClO3S/c1-4-24-19(22)18-17(13-8-6-5-7-11(13)2)14-10-15(21)12(3)9-16(14)25-20(18)23/h5-10H,4H2,1-3H3