(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl (E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl (E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoate CAS Name: (E)-2-cyano-3-(3-methoxyphenyl)-2-propenoic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl (E)-2-cyano-3-(3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-2-cyano-3-(3-methoxyphenyl)acrylic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C23H19NO5 MolecularWeight: 389.40066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C(=CC3=CC(=CC=C3)OC)C#N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)/C(=C/C3=CC(=CC=C3)OC)/C#N)C

InChI

InChI=1S/C23H19NO5/c1-14-7-20-18(11-22(25)29-21(20)8-15(14)2)13-28-23(26)17(12-24)9-16-5-4-6-19(10-16)27-3/h4-11H,13H2,1-3H3/b17-9+