(1R,2R,5S)-2-methanoyl-1,2-dimethyl-5-(phenylcarbonyloxymethyl)cyclopentane-1-carboxylic acid

Systemtic Name: (1R,2R,5S)-2-methanoyl-1,2-dimethyl-5-(phenylcarbonyloxymethyl)cyclopentane-1-carboxylic acid Openeye Name: (1R,2R,5S)-5-(benzoyloxymethyl)-2-formyl-1,2-dimethyl-cyclopentanecarboxylic acid CAS Name: (1R,2R,5S)-5-(benzoyloxymethyl)-2-formyl-1,2-dimethyl-1-cyclopentanecarboxylic acid IUPAC Name: (1R,2R,5S)-5-(benzoyloxymethyl)-2-formyl-1,2-dimethylcyclopentane-1-carboxylic acid Traditional Name: (1R,2R,5S)-5-(benzoyloxymethyl)-2-formyl-1,2-dimethyl-cyclopentanecarboxylic acid Formula: C17H20O5 MolecularWeight: 304.3377

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C1(C)C(=O)O)COC(=O)C2=CC=CC=C2)C=O

Isomeric SMILES

C[C@]1(CC[C@@H]([C@@]1(C)C(=O)O)COC(=O)C2=CC=CC=C2)C=O

InChI

InChI=1S/C17H20O5/c1-16(11-18)9-8-13(17(16,2)15(20)21)10-22-14(19)12-6-4-3-5-7-12/h3-7,11,13H,8-10H2,1-2H3,(H,20,21)/t13-,16+,17+/m1/s1