methyl (3aR,7R,7aS)-3,7,7a-trimethyl-4-oxidanylidene-1,5,6,7-tetrahydroindene-3a-carboxylate

Systemtic Name: methyl (3aR,7R,7aS)-3,7,7a-trimethyl-4-oxidanylidene-1,5,6,7-tetrahydroindene-3a-carboxylate Openeye Name: methyl (3aR,7R,7aS)-3,7,7a-trimethyl-4-oxo-1,5,6,7-tetrahydroindene-3a-carboxylate CAS Name: (3aR,7R,7aS)-3,7,7a-trimethyl-4-oxo-1,5,6,7-tetrahydroindene-3a-carboxylic acid methyl ester IUPAC Name: methyl (3aR,7R,7aS)-3,7,7a-trimethyl-4-oxo-1,5,6,7-tetrahydroindene-3a-carboxylate Traditional Name: (3aR,7R,7aS)-4-keto-3,7,7a-trimethyl-1,5,6,7-tetrahydroindene-3a-carboxylic acid methyl ester Formula: C14H20O3 MolecularWeight: 236.3068

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)C2(C1(CC=C2C)C)C(=O)OC

Isomeric SMILES

C[C@@H]1CCC(=O)[C@@]2([C@]1(CC=C2C)C)C(=O)OC

InChI

InChI=1S/C14H20O3/c1-9-5-6-11(15)14(12(16)17-4)10(2)7-8-13(9,14)3/h7,9H,5-6,8H2,1-4H3/t9-,13+,14-/m1/s1