methyl 4-[(E)-4-methylpent-1-enyl]-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 4-[(E)-4-methylpent-1-enyl]-1-benzothiophene-2-carboxylate Openeye Name: methyl 4-[(E)-4-methylpent-1-enyl]benzothiophene-2-carboxylate CAS Name: 4-[(E)-4-methylpent-1-enyl]-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 4-[(E)-4-methylpent-1-enyl]-1-benzothiophene-2-carboxylate Traditional Name: 4-[(E)-4-methylpent-1-enyl]benzothiophene-2-carboxylic acid methyl ester Formula: C16H18O2S MolecularWeight: 274.37792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC=CC1=C2C=C(SC2=CC=C1)C(=O)OC

Isomeric SMILES

CC(C)C/C=C/C1=C2C=C(SC2=CC=C1)C(=O)OC

InChI

InChI=1S/C16H18O2S/c1-11(2)6-4-7-12-8-5-9-14-13(12)10-15(19-14)16(17)18-3/h4-5,7-11H,6H2,1-3H3/b7-4+