3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-naphthalen-1-yl-prop-2-enamide

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-naphthalen-1-yl-prop-2-enamide Openeye Name: 3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-cyano-N-(1-naphthyl)prop-2-enamide CAS Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(1-naphthalenyl)-2-propenamide IUPAC Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-naphthalen-1-ylprop-2-enamide Traditional Name: 3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-cyano-N-(1-naphthyl)acrylamide Formula: C21H15BrN2O3 MolecularWeight: 423.2594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC3=CC=CC=C32)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2=CC=CC3=CC=CC=C32)Br)O

InChI

InChI=1S/C21H15BrN2O3/c1-27-19-11-13(10-17(22)20(19)25)9-15(12-23)21(26)24-18-8-4-6-14-5-2-3-7-16(14)18/h2-11,25H,1H3,(H,24,26)