(E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-2-cyano-N-[(1R)-1-phenylethyl]prop-2-enamide

Systemtic Name: (E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-2-cyano-N-[(1R)-1-phenylethyl]prop-2-enamide Openeye Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-2-cyano-N-[(1R)-1-phenylethyl]prop-2-enamide CAS Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-2-cyano-N-[(1R)-1-phenylethyl]-2-propenamide IUPAC Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-2-cyano-N-[(1R)-1-phenylethyl]prop-2-enamide Traditional Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-2-cyano-N-[(1R)-1-phenylethyl]acrylamide Formula: C19H17BrN2O3 MolecularWeight: 401.25388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(=CC2=CC(=C(C=C2Br)OC)O)C#N

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)/C(=C/C2=CC(=C(C=C2Br)OC)O)/C#N

InChI

InChI=1S/C19H17BrN2O3/c1-12(13-6-4-3-5-7-13)22-19(24)15(11-21)8-14-9-17(23)18(25-2)10-16(14)20/h3-10,12,23H,1-2H3,(H,22,24)/b15-8+/t12-/m1/s1