ethyl (E)-2-cyano-3-[2-(2-pyridin-2-ylquinolin-4-yl)carbonylhydrazinyl]prop-2-enoate

Systemtic Name: ethyl (E)-2-cyano-3-[2-(2-pyridin-2-ylquinolin-4-yl)carbonylhydrazinyl]prop-2-enoate Openeye Name: ethyl (E)-2-cyano-3-[2-[2-(2-pyridyl)quinoline-4-carbonyl]hydrazino]prop-2-enoate CAS Name: (E)-2-cyano-3-[[oxo-[2-(2-pyridinyl)-4-quinolinyl]methyl]hydrazo]-2-propenoic acid ethyl ester IUPAC Name: ethyl (E)-2-cyano-3-[2-(2-pyridin-2-ylquinoline-4-carbonyl)hydrazinyl]prop-2-enoate Traditional Name: (E)-2-cyano-3-[N'-[2-(2-pyridyl)quinoline-4-carbonyl]hydrazino]acrylic acid ethyl ester Formula: C21H17N5O3 MolecularWeight: 387.39138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CNNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=N3)C#N

Isomeric SMILES

CCOC(=O)/C(=C/NNC(=O)C1=CC(=NC2=CC=CC=C21)C3=CC=CC=N3)/C#N

InChI

InChI=1S/C21H17N5O3/c1-2-29-21(28)14(12-22)13-24-26-20(27)16-11-19(18-9-5-6-10-23-18)25-17-8-4-3-7-15(16)17/h3-11,13,24H,2H2,1H3,(H,26,27)/b14-13+