N-(3-bromophenyl)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-prop-2-enamide

Systemtic Name: N-(3-bromophenyl)-3-(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-prop-2-enamide Openeye Name: N-(3-bromophenyl)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)-2-cyano-prop-2-enamide CAS Name: N-(3-bromophenyl)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyano-2-propenamide IUPAC Name: N-(3-bromophenyl)-3-(3-chloro-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide Traditional Name: N-(3-bromophenyl)-3-(3-chloro-4-hydroxy-5-methoxy-phenyl)-2-cyano-acrylamide Formula: C17H12BrClN2O3 MolecularWeight: 407.64578

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)Br)Cl)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)Br)Cl)O

InChI

InChI=1S/C17H12BrClN2O3/c1-24-15-7-10(6-14(19)16(15)22)5-11(9-20)17(23)21-13-4-2-3-12(18)8-13/h2-8,22H,1H3,(H,21,23)