methyl 4-[(E)-2,6-dimethyl-4-oxidanylidene-hept-2-enoxy]-3-oxidanyl-benzoate

Systemtic Name: methyl 4-[(E)-2,6-dimethyl-4-oxidanylidene-hept-2-enoxy]-3-oxidanyl-benzoate Openeye Name: methyl 4-[(E)-2,6-dimethyl-4-oxo-hept-2-enoxy]-3-hydroxy-benzoate CAS Name: 4-[(E)-2,6-dimethyl-4-oxohept-2-enoxy]-3-hydroxybenzoic acid methyl ester IUPAC Name: methyl 4-[(E)-2,6-dimethyl-4-oxohept-2-enoxy]-3-hydroxybenzoate Traditional Name: 3-hydroxy-4-[(E)-4-keto-2,6-dimethyl-hept-2-enoxy]benzoic acid methyl ester Formula: C17H22O5 MolecularWeight: 306.35358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H22O5/c1-11(2)7-14(18)8-12(3)10-22-16-6-5-13(9-15(16)19)17(20)21-4/h5-6,8-9,11,19H,7,10H2,1-4H3/b12-8+