(3-oxidanylidenebenzo[f]chromen-1-yl)methyl (E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl (E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl (E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(3-methoxyphenyl)-2-propenoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl (E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(3-methoxyphenyl)acrylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C25H17NO5 MolecularWeight: 411.40618

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C=C(C#N)C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

COC1=CC=CC(=C1)/C=C(\C#N)/C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C25H17NO5/c1-29-20-7-4-5-16(12-20)11-18(14-26)25(28)30-15-19-13-23(27)31-22-10-9-17-6-2-3-8-21(17)24(19)22/h2-13H,15H2,1H3/b18-11+