(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-butoxy-3-ethoxy-benzoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 4-butoxy-3-ethoxy-benzoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 4-butoxy-3-ethoxy-benzoate CAS Name: 4-butoxy-3-ethoxybenzoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 4-butoxy-3-ethoxybenzoate Traditional Name: 4-butoxy-3-ethoxy-benzoic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C25H28O6 MolecularWeight: 424.48622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3C)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3C)C)OCC

InChI

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