(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3,4-diethoxybenzoate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl 3,4-diethoxybenzoate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl 3,4-diethoxybenzoate CAS Name: 3,4-diethoxybenzoic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl 3,4-diethoxybenzoate Traditional Name: 3,4-diethoxybenzoic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C25H28O6 MolecularWeight: 424.48622

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C(C)C)C)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)OC3=CC(=C(C=C23)C(C)C)C)OCC

InChI

InChI=1S/C25H28O6/c1-6-28-21-9-8-17(11-23(21)29-7-2)25(27)30-14-18-12-24(26)31-22-10-16(5)19(15(3)4)13-20(18)22/h8-13,15H,6-7,14H2,1-5H3