ethyl (Z)-2-cyano-5-methyl-3-[(E)-2-(6-methyl-4-oxidanylidene-chromen-3-yl)ethenyl]hex-2-enoate

Systemtic Name: ethyl (Z)-2-cyano-5-methyl-3-[(E)-2-(6-methyl-4-oxidanylidene-chromen-3-yl)ethenyl]hex-2-enoate Openeye Name: ethyl (Z)-2-cyano-5-methyl-3-[(E)-2-(6-methyl-4-oxo-chromen-3-yl)vinyl]hex-2-enoate CAS Name: (Z)-2-cyano-5-methyl-3-[(E)-2-(6-methyl-4-oxo-1-benzopyran-3-yl)ethenyl]-2-hexenoic acid ethyl ester IUPAC Name: ethyl (Z)-2-cyano-5-methyl-3-[(E)-2-(6-methyl-4-oxochromen-3-yl)ethenyl]hex-2-enoate Traditional Name: (2Z,4E)-2-cyano-3-isobutyl-5-(4-keto-6-methyl-chromen-3-yl)penta-2,4-dienoic acid ethyl ester Formula: C22H23NO4 MolecularWeight: 365.42232

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(CC(C)C)C=CC1=COC2=C(C1=O)C=C(C=C2)C)C#N

Isomeric SMILES

CCOC(=O)/C(=C(/CC(C)C)\C=C\C1=COC2=C(C1=O)C=C(C=C2)C)/C#N

InChI

InChI=1S/C22H23NO4/c1-5-26-22(25)19(12-23)16(10-14(2)3)7-8-17-13-27-20-9-6-15(4)11-18(20)21(17)24/h6-9,11,13-14H,5,10H2,1-4H3/b8-7+,19-16+