(1R,6S)-6-(2,5-dimethylphenyl)carbonyl-3,4-dimethyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: (1R,6S)-6-(2,5-dimethylphenyl)carbonyl-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Openeye Name: (1R,6S)-6-(2,5-dimethylbenzoyl)-3,4-dimethyl-cyclohex-3-ene-1-carboxylate CAS Name: (1R,6S)-6-[(2,5-dimethylphenyl)-oxomethyl]-3,4-dimethyl-1-cyclohex-3-enecarboxylate IUPAC Name: (1R,6S)-6-(2,5-dimethylbenzoyl)-3,4-dimethylcyclohex-3-ene-1-carboxylate Traditional Name: (1R,6S)-6-(2,5-dimethylbenzoyl)-3,4-dimethyl-cyclohex-3-ene-1-carboxylate Formula: C18H21O3- MolecularWeight: 285.35754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CC(C(C1)C(=O)C2=C(C=CC(=C2)C)C)C(=O)[O-])C

Isomeric SMILES

CC1=C(C[C@H]([C@H](C1)C(=O)C2=C(C=CC(=C2)C)C)C(=O)[O-])C

InChI

InChI=1S/C18H22O3/c1-10-5-6-11(2)14(7-10)17(19)15-8-12(3)13(4)9-16(15)18(20)21/h5-7,15-16H,8-9H2,1-4H3,(H,20,21)/p-1/t15-,16+/m0/s1