hex-5-enyl 1-methylcyclohexa-2,5-diene-1-carboxylate

Systemtic Name: hex-5-enyl 1-methylcyclohexa-2,5-diene-1-carboxylate Openeye Name: hex-5-enyl 1-methylcyclohexa-2,5-diene-1-carboxylate CAS Name: 1-methyl-1-cyclohexa-2,5-dienecarboxylic acid hex-5-enyl ester IUPAC Name: hex-5-enyl 1-methylcyclohexa-2,5-diene-1-carboxylate Traditional Name: 1-methylcyclohexa-2,5-diene-1-carboxylic acid hex-5-enyl ester Formula: C14H20O2 MolecularWeight: 220.3074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CCC=C1)C(=O)OCCCCC=C

Isomeric SMILES

CC1(C=CCC=C1)C(=O)OCCCCC=C

InChI

InChI=1S/C14H20O2/c1-3-4-5-9-12-16-13(15)14(2)10-7-6-8-11-14/h3,7-8,10-11H,1,4-6,9,12H2,2H3