[4-[2-cyano-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]-2-methoxy-phenyl] 3,3-dimethylbutanoate

Systemtic Name: [4-[2-cyano-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]-2-methoxy-phenyl] 3,3-dimethylbutanoate Openeye Name: [4-[3-(allylamino)-2-cyano-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [4-[2-cyano-3-oxo-3-(prop-2-enylamino)prop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[2-cyano-3-oxo-3-(prop-2-enylamino)prop-1-enyl]-2-methoxyphenyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [4-[3-(allylamino)-2-cyano-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C20H24N2O4 MolecularWeight: 356.41556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=C(C=C(C=C1)C=C(C#N)C(=O)NCC=C)OC

Isomeric SMILES

CC(C)(C)CC(=O)OC1=C(C=C(C=C1)C=C(C#N)C(=O)NCC=C)OC

InChI

InChI=1S/C20H24N2O4/c1-6-9-22-19(24)15(13-21)10-14-7-8-16(17(11-14)25-5)26-18(23)12-20(2,3)4/h6-8,10-11H,1,9,12H2,2-5H3,(H,22,24)