(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl (E)-2-cyano-3-(4-methylphenyl)prop-2-enoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl (E)-2-cyano-3-(4-methylphenyl)prop-2-enoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl (E)-2-cyano-3-(p-tolyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(4-methylphenyl)-2-propenoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl (E)-2-cyano-3-(4-methylphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(p-tolyl)acrylic acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C22H17NO5 MolecularWeight: 375.37408

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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=C2C=CC(=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C#N)/C(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C22H17NO5/c1-14-3-5-15(6-4-14)9-16(12-23)22(25)27-13-17-10-21(24)28-20-11-18(26-2)7-8-19(17)20/h3-11H,13H2,1-2H3/b16-9+