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

Systemtic Name: [4-[2-cyano-3-oxidanylidene-3-(prop-2-enylamino)prop-1-enyl]-2-methoxy-phenyl] 3-methylbutanoate Openeye Name: [4-[3-(allylamino)-2-cyano-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 3-methylbutanoate CAS Name: 3-methylbutanoic 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-methylbutanoate Traditional Name: 3-methylbutyric acid [4-[3-(allylamino)-2-cyano-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C19H22N2O4 MolecularWeight: 342.38898

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O4/c1-5-8-21-19(23)15(12-20)10-14-6-7-16(17(11-14)24-4)25-18(22)9-13(2)3/h5-7,10-11,13H,1,8-9H2,2-4H3,(H,21,23)