[(8aS)-4,8a-dimethyl-3-oxidanylidene-1,2,5,6,7,8-hexahydronaphthalen-2-yl] benzoate

Systemtic Name: [(8aS)-4,8a-dimethyl-3-oxidanylidene-1,2,5,6,7,8-hexahydronaphthalen-2-yl] benzoate Openeye Name: [(8aS)-4,8a-dimethyl-3-oxo-1,2,5,6,7,8-hexahydronaphthalen-2-yl] benzoate CAS Name: benzoic acid [(8aS)-4,8a-dimethyl-3-oxo-1,2,5,6,7,8-hexahydronaphthalen-2-yl] ester IUPAC Name: [(8aS)-4,8a-dimethyl-3-oxo-1,2,5,6,7,8-hexahydronaphthalen-2-yl] benzoate Traditional Name: benzoic acid [(8aS)-3-keto-4,8a-dimethyl-1,2,5,6,7,8-hexahydronaphthalen-2-yl] ester Formula: C19H22O3 MolecularWeight: 298.37618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCCC2(CC(C1=O)OC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C2CCCC[C@]2(CC(C1=O)OC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C19H22O3/c1-13-15-10-6-7-11-19(15,2)12-16(17(13)20)22-18(21)14-8-4-3-5-9-14/h3-5,8-9,16H,6-7,10-12H2,1-2H3/t16?,19-/m0/s1