[(E)-3-methylbut-1-enyl] 3-(2-methanoylthiophen-3-yl)benzoate

Systemtic Name: [(E)-3-methylbut-1-enyl] 3-(2-methanoylthiophen-3-yl)benzoate Openeye Name: [(E)-3-methylbut-1-enyl] 3-(2-formyl-3-thienyl)benzoate CAS Name: 3-(2-formyl-3-thiophenyl)benzoic acid [(E)-3-methylbut-1-enyl] ester IUPAC Name: [(E)-3-methylbut-1-enyl] 3-(2-formylthiophen-3-yl)benzoate Traditional Name: 3-(2-formyl-3-thienyl)benzoic acid [(E)-3-methylbut-1-enyl] ester Formula: C17H16O3S MolecularWeight: 300.37214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C=COC(=O)C1=CC=CC(=C1)C2=C(SC=C2)C=O

Isomeric SMILES

CC(C)/C=C/OC(=O)C1=CC=CC(=C1)C2=C(SC=C2)C=O

InChI

InChI=1S/C17H16O3S/c1-12(2)6-8-20-17(19)14-5-3-4-13(10-14)15-7-9-21-16(15)11-18/h3-12H,1-2H3/b8-6+