(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1-benzothiophene-2-carboxylate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1-benzothiophene-2-carboxylate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl benzothiophene-2-carboxylate CAS Name: 1-benzothiophene-2-carboxylic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 1-benzothiophene-2-carboxylate Traditional Name: benzothiophene-2-carboxylic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H16O4S MolecularWeight: 364.41434

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC4=CC=CC=C4S3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC4=CC=CC=C4S3)C

InChI

InChI=1S/C21H16O4S/c1-12-7-16-15(10-20(22)25-17(16)8-13(12)2)11-24-21(23)19-9-14-5-3-4-6-18(14)26-19/h3-10H,11H2,1-2H3