[(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-yl] thiophene-2-carboxylate

Systemtic Name: [(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethyl-pent-1-en-3-yl] thiophene-2-carboxylate Openeye Name: [(E)-3-(1,3-benzodioxol-5-yl)-1-tert-butyl-allyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethylpent-1-en-3-yl] ester IUPAC Name: [(E)-1-(1,3-benzodioxol-5-yl)-4,4-dimethylpent-1-en-3-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [(E)-3-(1,3-benzodioxol-5-yl)-1-tert-butyl-allyl] ester Formula: C19H20O4S MolecularWeight: 344.4247

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C=CC1=CC2=C(C=C1)OCO2)OC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)C(/C=C/C1=CC2=C(C=C1)OCO2)OC(=O)C3=CC=CS3

InChI

InChI=1S/C19H20O4S/c1-19(2,3)17(23-18(20)16-5-4-10-24-16)9-7-13-6-8-14-15(11-13)22-12-21-14/h4-11,17H,12H2,1-3H3/b9-7+