(3-oxidanylidenebenzo[f]chromen-1-yl)methyl (E)-2-cyano-3-(4-methylphenyl)prop-2-enoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl (E)-2-cyano-3-(4-methylphenyl)prop-2-enoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl (E)-2-cyano-3-(p-tolyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methylphenyl)-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-(4-methylphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(p-tolyl)acrylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C25H17NO4 MolecularWeight: 395.40678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C#N)C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3

InChI

InChI=1S/C25H17NO4/c1-16-6-8-17(9-7-16)12-19(14-26)25(28)29-15-20-13-23(27)30-22-11-10-18-4-2-3-5-21(18)24(20)22/h2-13H,15H2,1H3/b19-12+