ethyl 4-[[(E)-4-azanyl-3-cyano-4-oxidanylidene-but-2-en-2-yl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-4-azanyl-3-cyano-4-oxidanylidene-but-2-en-2-yl]amino]benzoate Openeye Name: ethyl 4-[[(E)-3-amino-2-cyano-1-methyl-3-oxo-prop-1-enyl]amino]benzoate CAS Name: 4-[[(E)-4-amino-3-cyano-4-oxobut-2-en-2-yl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-4-amino-3-cyano-4-oxobut-2-en-2-yl]amino]benzoate Traditional Name: 4-[[(E)-3-amino-2-cyano-3-keto-1-methyl-prop-1-enyl]amino]benzoic acid ethyl ester Formula: C14H15N3O3 MolecularWeight: 273.2872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=C(C#N)C(=O)N)C

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3O3/c1-3-20-14(19)10-4-6-11(7-5-10)17-9(2)12(8-15)13(16)18/h4-7,17H,3H2,1-2H3,(H2,16,18)/b12-9+