ethyl (2E)-2-[[[3-(3,5-dimethylpyridin-4-yl)phenyl]amino]methylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2E)-2-[[[3-(3,5-dimethylpyridin-4-yl)phenyl]amino]methylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl (2E)-2-[[3-(3,5-dimethyl-4-pyridyl)anilino]methylene]-3-oxo-butanoate CAS Name: (2E)-2-[[3-(3,5-dimethyl-4-pyridinyl)anilino]methylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2E)-2-[[3-(3,5-dimethylpyridin-4-yl)anilino]methylidene]-3-oxobutanoate Traditional Name: (E)-2-acetyl-3-[3-(3,5-dimethyl-4-pyridyl)anilino]acrylic acid ethyl ester Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC(=C1)C2=C(C=NC=C2C)C)C(=O)C

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=CC(=C1)C2=C(C=NC=C2C)C)/C(=O)C

InChI

InChI=1S/C20H22N2O3/c1-5-25-20(24)18(15(4)23)12-22-17-8-6-7-16(9-17)19-13(2)10-21-11-14(19)3/h6-12,22H,5H2,1-4H3/b18-12+