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

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoate CAS Name: 3-(4-butoxy-3-ethoxyphenyl)-2-propenoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 3-(4-butoxy-3-ethoxyphenyl)prop-2-enoate Traditional Name: 3-(4-butoxy-3-ethoxy-phenyl)acrylic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C27H30O6 MolecularWeight: 450.5235

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30O6/c1-5-7-14-31-23-12-9-20(15-24(23)30-6-2)10-13-25(28)32-17-21-16-26(29)33-27-19(4)18(3)8-11-22(21)27/h8-13,15-16H,5-7,14,17H2,1-4H3