dimethyl 2-[(1S,4R)-4-(phenylcarbonyloxy)cyclohex-2-en-1-yl]propanedioate

Systemtic Name: dimethyl 2-[(1S,4R)-4-(phenylcarbonyloxy)cyclohex-2-en-1-yl]propanedioate Openeye Name: dimethyl 2-[(1S,4R)-4-benzoyloxycyclohex-2-en-1-yl]propanedioate CAS Name: 2-[(1S,4R)-4-benzoyloxy-1-cyclohex-2-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(1S,4R)-4-benzoyloxycyclohex-2-en-1-yl]propanedioate Traditional Name: 2-[(1S,4R)-4-benzoyloxycyclohex-2-en-1-yl]malonic acid dimethyl ester Formula: C18H20O6 MolecularWeight: 332.3478

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1CCC(C=C1)OC(=O)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C([C@H]1CC[C@H](C=C1)OC(=O)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C18H20O6/c1-22-17(20)15(18(21)23-2)12-8-10-14(11-9-12)24-16(19)13-6-4-3-5-7-13/h3-8,10,12,14-15H,9,11H2,1-2H3/t12-,14+/m1/s1