3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-(phenylmethyl)prop-2-enamide

Systemtic Name: 3-(3-bromanyl-5-methoxy-4-oxidanyl-phenyl)-2-cyano-N-(phenylmethyl)prop-2-enamide Openeye Name: N-benzyl-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-cyano-prop-2-enamide CAS Name: 3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(phenylmethyl)-2-propenamide IUPAC Name: N-benzyl-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyanoprop-2-enamide Traditional Name: N-benzyl-3-(3-bromo-4-hydroxy-5-methoxy-phenyl)-2-cyano-acrylamide Formula: C18H15BrN2O3 MolecularWeight: 387.2273

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NCC2=CC=CC=C2)Br)O

Isomeric SMILES

COC1=C(C(=CC(=C1)C=C(C#N)C(=O)NCC2=CC=CC=C2)Br)O

InChI

InChI=1S/C18H15BrN2O3/c1-24-16-9-13(8-15(19)17(16)22)7-14(10-20)18(23)21-11-12-5-3-2-4-6-12/h2-9,22H,11H2,1H3,(H,21,23)