(7-methyl-7-oxidanyl-8-oxidanylidene-3-propyl-5,6-dihydro-1H-isochromen-6-yl) 4-methoxy-2-methyl-6-oxidanyl-benzoate

Systemtic Name: (7-methyl-7-oxidanyl-8-oxidanylidene-3-propyl-5,6-dihydro-1H-isochromen-6-yl) 4-methoxy-2-methyl-6-oxidanyl-benzoate Openeye Name: (7-hydroxy-7-methyl-8-oxo-3-propyl-5,6-dihydro-1H-isochromen-6-yl) 2-hydroxy-4-methoxy-6-methyl-benzoate CAS Name: 2-hydroxy-4-methoxy-6-methylbenzoic acid (7-hydroxy-7-methyl-8-oxo-3-propyl-5,6-dihydro-1H-2-benzopyran-6-yl) ester IUPAC Name: (7-hydroxy-7-methyl-8-oxo-3-propyl-5,6-dihydro-1H-isochromen-6-yl) 2-hydroxy-4-methoxy-6-methylbenzoate Traditional Name: 2-hydroxy-4-methoxy-6-methyl-benzoic acid (7-hydroxy-8-keto-7-methyl-3-propyl-5,6-dihydro-1H-isochromen-6-yl) ester Formula: C22H26O7 MolecularWeight: 402.43764

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC2=C(CO1)C(=O)C(C(C2)OC(=O)C3=C(C=C(C=C3C)OC)O)(C)O

Isomeric SMILES

CCCC1=CC2=C(CO1)C(=O)C(C(C2)OC(=O)C3=C(C=C(C=C3C)OC)O)(C)O

InChI

InChI=1S/C22H26O7/c1-5-6-14-8-13-9-18(22(3,26)20(24)16(13)11-28-14)29-21(25)19-12(2)7-15(27-4)10-17(19)23/h7-8,10,18,23,26H,5-6,9,11H2,1-4H3