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

Systemtic Name: (E)-3-[3-chloranyl-4,5-bis(oxidanyl)phenyl]-2-cyano-N-phenethyl-prop-2-enamide Openeye Name: (E)-3-(3-chloro-4,5-dihydroxy-phenyl)-2-cyano-N-phenethyl-prop-2-enamide CAS Name: (E)-3-(3-chloro-4,5-dihydroxyphenyl)-2-cyano-N-phenethyl-2-propenamide IUPAC Name: (E)-3-(3-chloro-4,5-dihydroxyphenyl)-2-cyano-N-phenethylprop-2-enamide Traditional Name: (E)-3-(3-chloro-4,5-dihydroxy-phenyl)-2-cyano-N-phenethyl-acrylamide Formula: C18H15ClN2O3 MolecularWeight: 342.7763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC(=O)C(=CC2=CC(=C(C(=C2)Cl)O)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)CCNC(=O)/C(=C/C2=CC(=C(C(=C2)Cl)O)O)/C#N

InChI

InChI=1S/C18H15ClN2O3/c19-15-9-13(10-16(22)17(15)23)8-14(11-20)18(24)21-7-6-12-4-2-1-3-5-12/h1-5,8-10,22-23H,6-7H2,(H,21,24)/b14-8+