methyl 4-[(1E)-2,6-dimethyl-4-oxidanylidene-hepta-1,5-dienoxy]-3-oxidanyl-benzoate

Systemtic Name: methyl 4-[(1E)-2,6-dimethyl-4-oxidanylidene-hepta-1,5-dienoxy]-3-oxidanyl-benzoate Openeye Name: methyl 4-[(1E)-2,6-dimethyl-4-oxo-hepta-1,5-dienoxy]-3-hydroxy-benzoate CAS Name: 4-[(1E)-2,6-dimethyl-4-oxohepta-1,5-dienoxy]-3-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-[(1E)-2,6-dimethyl-4-oxohepta-1,5-dienoxy]-3-hydroxybenzoate Traditional Name: 3-hydroxy-4-[(1E)-4-keto-2,6-dimethyl-hepta-1,5-dienoxy]benzoic acid methyl ester Formula: C17H20O5 MolecularWeight: 304.3377

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)CC(=COC1=C(C=C(C=C1)C(=O)OC)O)C)C

Isomeric SMILES

CC(=CC(=O)C/C(=C/OC1=C(C=C(C=C1)C(=O)OC)O)/C)C

InChI

InChI=1S/C17H20O5/c1-11(2)7-14(18)8-12(3)10-22-16-6-5-13(9-15(16)19)17(20)21-4/h5-7,9-10,19H,8H2,1-4H3/b12-10+