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

Systemtic Name: (E)-3-(2-bromanyl-4-methoxy-5-oxidanyl-phenyl)-2-cyano-N-propan-2-yl-prop-2-enamide Openeye Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-2-cyano-N-isopropyl-prop-2-enamide CAS Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-2-cyano-N-propan-2-yl-2-propenamide IUPAC Name: (E)-3-(2-bromo-5-hydroxy-4-methoxyphenyl)-2-cyano-N-propan-2-ylprop-2-enamide Traditional Name: (E)-3-(2-bromo-5-hydroxy-4-methoxy-phenyl)-2-cyano-N-isopropyl-acrylamide Formula: C14H15BrN2O3 MolecularWeight: 339.1845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC(=C(C=C1Br)OC)O)C#N

Isomeric SMILES

CC(C)NC(=O)/C(=C/C1=CC(=C(C=C1Br)OC)O)/C#N

InChI

InChI=1S/C14H15BrN2O3/c1-8(2)17-14(19)10(7-16)4-9-5-12(18)13(20-3)6-11(9)15/h4-6,8,18H,1-3H3,(H,17,19)/b10-4+