methyl (3aS,9bS)-3,3-dimethyl-1-oxidanylidene-2,3a,4,5-tetrahydrocyclopenta[a]naphthalene-9b-carboxylate

Systemtic Name: methyl (3aS,9bS)-3,3-dimethyl-1-oxidanylidene-2,3a,4,5-tetrahydrocyclopenta[a]naphthalene-9b-carboxylate Openeye Name: methyl (3aS,9bS)-3,3-dimethyl-1-oxo-2,3a,4,5-tetrahydrocyclopenta[a]naphthalene-9b-carboxylate CAS Name: (3aS,9bS)-3,3-dimethyl-1-oxo-2,3a,4,5-tetrahydrocyclopenta[a]naphthalene-9b-carboxylic acid methyl ester IUPAC Name: methyl (3aS,9bS)-3,3-dimethyl-1-oxo-2,3a,4,5-tetrahydrocyclopenta[a]naphthalene-9b-carboxylate Traditional Name: (3aS,9bS)-1-keto-3,3-dimethyl-2,3a,4,5-tetrahydrobenz[e]indene-9b-carboxylic acid methyl ester Formula: C17H20O3 MolecularWeight: 272.3389

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C2(C1CCC3=CC=CC=C32)C(=O)OC)C

Isomeric SMILES

CC1(CC(=O)[C@@]2([C@H]1CCC3=CC=CC=C32)C(=O)OC)C

InChI

InChI=1S/C17H20O3/c1-16(2)10-14(18)17(15(19)20-3)12-7-5-4-6-11(12)8-9-13(16)17/h4-7,13H,8-10H2,1-3H3/t13-,17+/m0/s1