(2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl) 2,3-dihydro-1-benzothiophene-2-carboxylate

Systemtic Name: (2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl) 2,3-dihydro-1-benzothiophene-2-carboxylate Openeye Name: (2-methyl-4-oxo-3-phenyl-chromen-7-yl) 2,3-dihydrobenzothiophene-2-carboxylate CAS Name: 2,3-dihydro-1-benzothiophene-2-carboxylic acid (2-methyl-4-oxo-3-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (2-methyl-4-oxo-3-phenylchromen-7-yl) 2,3-dihydro-1-benzothiophene-2-carboxylate Traditional Name: 2,3-dihydrobenzothiophene-2-carboxylic acid (4-keto-2-methyl-3-phenyl-chromen-7-yl) ester Formula: C25H18O4S MolecularWeight: 414.47302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3CC4=CC=CC=C4S3)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3CC4=CC=CC=C4S3)C5=CC=CC=C5

InChI

InChI=1S/C25H18O4S/c1-15-23(16-7-3-2-4-8-16)24(26)19-12-11-18(14-20(19)28-15)29-25(27)22-13-17-9-5-6-10-21(17)30-22/h2-12,14,22H,13H2,1H3