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

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 1-benzothiophene-2-carboxylate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl benzothiophene-2-carboxylate CAS Name: 1-benzothiophene-2-carboxylic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 1-benzothiophene-2-carboxylate Traditional Name: benzothiophene-2-carboxylic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C23H20O4S MolecularWeight: 392.4675

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC4=CC=CC=C4S3)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC4=CC=CC=C4S3)C(C)C

InChI

InChI=1S/C23H20O4S/c1-13(2)17-11-18-16(10-22(24)27-19(18)8-14(17)3)12-26-23(25)21-9-15-6-4-5-7-20(15)28-21/h4-11,13H,12H2,1-3H3