(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate CAS Name: (E)-3-(4-cyanophenyl)-2-propenoic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl (E)-3-(4-cyanophenyl)prop-2-enoate Traditional Name: (E)-3-(4-cyanophenyl)acrylic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C22H17NO4 MolecularWeight: 359.37468

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C=CC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)/C=C/C3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C22H17NO4/c1-14-3-9-19-18(11-21(25)27-22(19)15(14)2)13-26-20(24)10-8-16-4-6-17(12-23)7-5-16/h3-11H,13H2,1-2H3/b10-8+