methyl 3-(3-methylbut-3-enyl)-4-oxidanyl-benzoate

Systemtic Name: methyl 3-(3-methylbut-3-enyl)-4-oxidanyl-benzoate Openeye Name: methyl 4-hydroxy-3-(3-methylbut-3-enyl)benzoate CAS Name: 4-hydroxy-3-(3-methylbut-3-enyl)benzoic acid methyl ester IUPAC Name: methyl 4-hydroxy-3-(3-methylbut-3-enyl)benzoate Traditional Name: 4-hydroxy-3-(3-methylbut-3-enyl)benzoic acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CCC1=C(C=CC(=C1)C(=O)OC)O

Isomeric SMILES

CC(=C)CCC1=C(C=CC(=C1)C(=O)OC)O

InChI

InChI=1S/C13H16O3/c1-9(2)4-5-10-8-11(13(15)16-3)6-7-12(10)14/h6-8,14H,1,4-5H2,2-3H3