(5-methylidene-3a,4,6,6a-tetrahydro-1H-pentalen-1-yl) 2,4,6-trimethylbenzoate

Systemtic Name: (5-methylidene-3a,4,6,6a-tetrahydro-1H-pentalen-1-yl) 2,4,6-trimethylbenzoate Openeye Name: (5-methylene-3a,4,6,6a-tetrahydro-1H-pentalen-1-yl) 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid (5-methylene-3a,4,6,6a-tetrahydro-1H-pentalen-1-yl) ester IUPAC Name: (5-methylidene-3a,4,6,6a-tetrahydro-1H-pentalen-1-yl) 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid (5-methylene-3a,4,6,6a-tetrahydro-1H-pentalen-1-yl) ester Formula: C19H22O2 MolecularWeight: 282.37678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OC2C=CC3C2CC(=C)C3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OC2C=CC3C2CC(=C)C3)C

InChI

InChI=1S/C19H22O2/c1-11-7-13(3)18(14(4)8-11)19(20)21-17-6-5-15-9-12(2)10-16(15)17/h5-8,15-17H,2,9-10H2,1,3-4H3