(E)-3-[3-chloranyl-4,5-bis(oxidanyl)phenyl]-2-cyano-N-propan-2-yl-prop-2-enamide

Systemtic Name: (E)-3-[3-chloranyl-4,5-bis(oxidanyl)phenyl]-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-(3-chloro-4,5-dihydroxy-phenyl)-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-(3-chloro-4,5-dihydroxyphenyl)-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-(3-chloro-4,5-dihydroxyphenyl)-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-(3-chloro-4,5-dihydroxy-phenyl)-2-cyano-N-isopropyl-acrylamide Formula: C13H13ClN2O3 MolecularWeight: 280.70692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC(=C(C(=C1)Cl)O)O)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CC(=C(C(=C1)Cl)O)O)/C#N

InChI

InChI=1S/C13H13ClN2O3/c1-7(2)16-13(19)9(6-15)3-8-4-10(14)12(18)11(17)5-8/h3-5,7,17-18H,1-2H3,(H,16,19)/b9-3+