(Z)-3-[5-chloranyl-2-(3-methylbutoxy)phenyl]-2-cyano-N-(pyridin-2-ylmethyl)prop-2-enamide

Systemtic Name: (Z)-3-[5-chloranyl-2-(3-methylbutoxy)phenyl]-2-cyano-N-(pyridin-2-ylmethyl)prop-2-enamide Openeye Name: (Z)-3-(5-chloro-2-isopentyloxy-phenyl)-2-cyano-N-(2-pyridylmethyl)prop-2-enamide CAS Name: (Z)-3-[5-chloro-2-(3-methylbutoxy)phenyl]-2-cyano-N-(2-pyridinylmethyl)-2-propenamide IUPAC Name: (Z)-3-[5-chloro-2-(3-methylbutoxy)phenyl]-2-cyano-N-(pyridin-2-ylmethyl)prop-2-enamide Traditional Name: (Z)-3-(5-chloro-2-isoamoxy-phenyl)-2-cyano-N-(2-pyridylmethyl)acrylamide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)Cl)C=C(C#N)C(=O)NCC2=CC=CC=N2

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)Cl)/C=C(/C#N)\C(=O)NCC2=CC=CC=N2

InChI

InChI=1S/C21H22ClN3O2/c1-15(2)8-10-27-20-7-6-18(22)12-16(20)11-17(13-23)21(26)25-14-19-5-3-4-9-24-19/h3-7,9,11-12,15H,8,10,14H2,1-2H3,(H,25,26)/b17-11-