ethyl 1-methyl-2-oxidanyl-4-oxidanylidene-3-[(Z)-4-phenylmethoxybut-2-enyl]cyclohex-2-ene-1-carboxylate

Systemtic Name: ethyl 1-methyl-2-oxidanyl-4-oxidanylidene-3-[(Z)-4-phenylmethoxybut-2-enyl]cyclohex-2-ene-1-carboxylate Openeye Name: ethyl 3-[(Z)-4-benzyloxybut-2-enyl]-2-hydroxy-1-methyl-4-oxo-cyclohex-2-ene-1-carboxylate CAS Name: 2-hydroxy-1-methyl-4-oxo-3-[(Z)-4-phenylmethoxybut-2-enyl]-1-cyclohex-2-enecarboxylic acid ethyl ester IUPAC Name: ethyl 2-hydroxy-1-methyl-4-oxo-3-[(Z)-4-phenylmethoxybut-2-enyl]cyclohex-2-ene-1-carboxylate Traditional Name: 3-[(Z)-4-benzoxybut-2-enyl]-2-hydroxy-4-keto-1-methyl-cyclohex-2-ene-1-carboxylic acid ethyl ester Formula: C21H26O5 MolecularWeight: 358.42814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC(=O)C(=C1O)CC=CCOCC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1(CCC(=O)C(=C1O)C/C=C\COCC2=CC=CC=C2)C

InChI

InChI=1S/C21H26O5/c1-3-26-20(24)21(2)13-12-18(22)17(19(21)23)11-7-8-14-25-15-16-9-5-4-6-10-16/h4-10,23H,3,11-15H2,1-2H3/b8-7-