3-methylbut-2-enyl 5-methyl-1,1-bis(oxidanylidene)-3-propan-2-ylidene-1-benzothiophene-6-carboxylate

Systemtic Name: 3-methylbut-2-enyl 5-methyl-1,1-bis(oxidanylidene)-3-propan-2-ylidene-1-benzothiophene-6-carboxylate Openeye Name: 3-methylbut-2-enyl 3-isopropylidene-5-methyl-1,1-dioxo-benzothiophene-6-carboxylate CAS Name: 5-methyl-1,1-dioxo-3-propan-2-ylidene-1-benzothiophene-6-carboxylic acid 3-methylbut-2-enyl ester IUPAC Name: 3-methylbut-2-enyl 5-methyl-1,1-dioxo-3-propan-2-ylidene-1-benzothiophene-6-carboxylate Traditional Name: 3-isopropylidene-1,1-diketo-5-methyl-benzothiophene-6-carboxylic acid 3-methylbut-2-enyl ester Formula: C18H22O4S MolecularWeight: 334.42988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=C(C)C)CS2(=O)=O)C(=O)OCC=C(C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=C(C)C)CS2(=O)=O)C(=O)OCC=C(C)C

InChI

InChI=1S/C18H22O4S/c1-11(2)6-7-22-18(19)14-9-17-15(8-13(14)5)16(12(3)4)10-23(17,20)21/h6,8-9H,7,10H2,1-5H3