2-[(1R,4R)-4-(4-methoxy-3-methoxycarbonyl-4-oxidanylidene-butyl)cyclohex-2-en-1-yl]ethanoic acid

Systemtic Name: 2-[(1R,4R)-4-(4-methoxy-3-methoxycarbonyl-4-oxidanylidene-butyl)cyclohex-2-en-1-yl]ethanoic acid Openeye Name: 2-[(1R,4R)-4-(4-methoxy-3-methoxycarbonyl-4-oxo-butyl)cyclohex-2-en-1-yl]acetic acid CAS Name: 2-[(1R,4R)-4-(4-methoxy-3-methoxycarbonyl-4-oxobutyl)-1-cyclohex-2-enyl]acetic acid IUPAC Name: 2-[(1R,4R)-4-(4-methoxy-3-methoxycarbonyl-4-oxobutyl)cyclohex-2-en-1-yl]acetic acid Traditional Name: 2-[(1R,4R)-4-(3-carbomethoxy-4-keto-4-methoxy-butyl)cyclohex-2-en-1-yl]acetic acid Formula: C15H22O6 MolecularWeight: 298.33158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCC1CCC(C=C1)CC(=O)O)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C15H22O6/c1-20-14(18)12(15(19)21-2)8-7-10-3-5-11(6-4-10)9-13(16)17/h3,5,10-12H,4,6-9H2,1-2H3,(H,16,17)/t10-,11-/m1/s1