(1R,3R)-3-ethyl-5-methoxycarbonyl-cyclohept-4-ene-1-carboxylic acid

Systemtic Name: (1R,3R)-3-ethyl-5-methoxycarbonyl-cyclohept-4-ene-1-carboxylic acid Openeye Name: (1R,3R)-3-ethyl-5-methoxycarbonyl-cyclohept-4-ene-1-carboxylic acid CAS Name: (1R,3R)-3-ethyl-5-methoxycarbonyl-1-cyclohept-4-enecarboxylic acid IUPAC Name: (1R,3R)-3-ethyl-5-methoxycarbonylcyclohept-4-ene-1-carboxylic acid Traditional Name: (1R,3R)-5-carbomethoxy-3-ethyl-cyclohept-4-ene-1-carboxylic acid Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC(CCC(=C1)C(=O)OC)C(=O)O

Isomeric SMILES

CC[C@@H]1C[C@@H](CCC(=C1)C(=O)OC)C(=O)O

InChI

InChI=1S/C12H18O4/c1-3-8-6-9(11(13)14)4-5-10(7-8)12(15)16-2/h7-9H,3-6H2,1-2H3,(H,13,14)/t8-,9-/m1/s1