ethyl 8-(4-chlorophenyl)-4-methyl-2-oxidanylidene-6-thiophen-2-yl-4a,7-dihydrochromene-3-carboxylate

Systemtic Name: ethyl 8-(4-chlorophenyl)-4-methyl-2-oxidanylidene-6-thiophen-2-yl-4a,7-dihydrochromene-3-carboxylate Openeye Name: ethyl 8-(4-chlorophenyl)-4-methyl-2-oxo-6-(2-thienyl)-4a,7-dihydrochromene-3-carboxylate CAS Name: 8-(4-chlorophenyl)-4-methyl-2-oxo-6-thiophen-2-yl-4a,7-dihydro-1-benzopyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-(4-chlorophenyl)-4-methyl-2-oxo-6-thiophen-2-yl-4a,7-dihydrochromene-3-carboxylate Traditional Name: 8-(4-chlorophenyl)-2-keto-4-methyl-6-(2-thienyl)-4a,7-dihydrochromene-3-carboxylic acid ethyl ester Formula: C23H19ClO4S MolecularWeight: 426.91256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2C=C(CC(=C2OC1=O)C3=CC=C(C=C3)Cl)C4=CC=CS4)C

Isomeric SMILES

CCOC(=O)C1=C(C2C=C(CC(=C2OC1=O)C3=CC=C(C=C3)Cl)C4=CC=CS4)C

InChI

InChI=1S/C23H19ClO4S/c1-3-27-22(25)20-13(2)17-11-15(19-5-4-10-29-19)12-18(21(17)28-23(20)26)14-6-8-16(24)9-7-14/h4-11,17H,3,12H2,1-2H3