ethyl (2E)-3-oxidanylidene-2-[[(3-pyridin-3-ylphenyl)amino]methylidene]butanoate

Systemtic Name: ethyl (2E)-3-oxidanylidene-2-[[(3-pyridin-3-ylphenyl)amino]methylidene]butanoate Openeye Name: ethyl (2E)-3-oxo-2-[[3-(3-pyridyl)anilino]methylene]butanoate CAS Name: (2E)-3-oxo-2-[[3-(3-pyridinyl)anilino]methylidene]butanoic acid ethyl ester IUPAC Name: ethyl (2E)-3-oxo-2-[(3-pyridin-3-ylanilino)methylidene]butanoate Traditional Name: (E)-2-acetyl-3-[3-(3-pyridyl)anilino]acrylic acid ethyl ester Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNC1=CC=CC(=C1)C2=CN=CC=C2)C(=O)C

Isomeric SMILES

CCOC(=O)/C(=C/NC1=CC=CC(=C1)C2=CN=CC=C2)/C(=O)C

InChI

InChI=1S/C18H18N2O3/c1-3-23-18(22)17(13(2)21)12-20-16-8-4-6-14(10-16)15-7-5-9-19-11-15/h4-12,20H,3H2,1-2H3/b17-12+