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

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) (E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) (E)-3-(4-butoxy-3-ethoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-butoxy-3-ethoxyphenyl)-2-propenoic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) (E)-3-(4-butoxy-3-ethoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-butoxy-3-ethoxy-phenyl)acrylic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C25H26O6 MolecularWeight: 422.47034

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C(=O)OC2=CC3=C(C=C2)C(=CC(=O)O3)C)OCC

InChI

InChI=1S/C25H26O6/c1-4-6-13-29-21-11-7-18(15-23(21)28-5-2)8-12-24(26)30-19-9-10-20-17(3)14-25(27)31-22(20)16-19/h7-12,14-16H,4-6,13H2,1-3H3/b12-8+