ethyl 4-[[(E)-2-cyano-3-pyridin-3-yl-prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 4-[[(E)-2-cyano-3-pyridin-3-yl-prop-2-enoyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-2-cyano-3-(3-pyridyl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-2-cyano-1-oxo-3-(3-pyridinyl)prop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-2-cyano-3-pyridin-3-ylprop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-2-cyano-3-(3-pyridyl)acryloyl]amino]benzoic acid ethyl ester Formula: C18H15N3O3 MolecularWeight: 321.33

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C(=CC2=CN=CC=C2)C#N

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)/C(=C/C2=CN=CC=C2)/C#N

InChI

InChI=1S/C18H15N3O3/c1-2-24-18(23)14-5-7-16(8-6-14)21-17(22)15(11-19)10-13-4-3-9-20-12-13/h3-10,12H,2H2,1H3,(H,21,22)/b15-10+