methyl 5-[(2,6,6-trimethylcyclohexen-1-yl)methyl]thiophene-2-carboxylate

Systemtic Name: methyl 5-[(2,6,6-trimethylcyclohexen-1-yl)methyl]thiophene-2-carboxylate Openeye Name: methyl 5-[(2,6,6-trimethylcyclohexen-1-yl)methyl]thiophene-2-carboxylate CAS Name: 5-[(2,6,6-trimethyl-1-cyclohexenyl)methyl]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(2,6,6-trimethylcyclohexen-1-yl)methyl]thiophene-2-carboxylate Traditional Name: 5-[(2,6,6-trimethylcyclohexen-1-yl)methyl]thiophene-2-carboxylic acid methyl ester Formula: C16H22O2S MolecularWeight: 278.40968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)CC2=CC=C(S2)C(=O)OC

Isomeric SMILES

CC1=C(C(CCC1)(C)C)CC2=CC=C(S2)C(=O)OC

InChI

InChI=1S/C16H22O2S/c1-11-6-5-9-16(2,3)13(11)10-12-7-8-14(19-12)15(17)18-4/h7-8H,5-6,9-10H2,1-4H3