methyl (4E)-4-butylidene-6,7-dihydro-5H-1-benzothiophene-2-carboxylate

Systemtic Name: methyl (4E)-4-butylidene-6,7-dihydro-5H-1-benzothiophene-2-carboxylate Openeye Name: methyl (4E)-4-butylidene-6,7-dihydro-5H-benzothiophene-2-carboxylate CAS Name: (4E)-4-butylidene-6,7-dihydro-5H-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl (4E)-4-butylidene-6,7-dihydro-5H-1-benzothiophene-2-carboxylate Traditional Name: (4E)-4-butylidene-6,7-dihydro-5H-benzothiophene-2-carboxylic acid methyl ester Formula: C14H18O2S MolecularWeight: 250.35652

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Descriptors Computed from Structure

Canonical SMILES:

CCCC=C1CCCC2=C1C=C(S2)C(=O)OC

Isomeric SMILES

CCC/C=C/1\CCCC2=C1C=C(S2)C(=O)OC

InChI

InChI=1S/C14H18O2S/c1-3-4-6-10-7-5-8-12-11(10)9-13(17-12)14(15)16-2/h6,9H,3-5,7-8H2,1-2H3/b10-6+