(E)-3-[5-bromanyl-2-[2-(cyanomethylamino)-2-oxidanylidene-ethoxy]phenyl]prop-2-enoate

Systemtic Name: (E)-3-[5-bromanyl-2-[2-(cyanomethylamino)-2-oxidanylidene-ethoxy]phenyl]prop-2-enoate Openeye Name: (E)-3-[5-bromo-2-[2-(cyanomethylamino)-2-oxo-ethoxy]phenyl]prop-2-enoate CAS Name: (E)-3-[5-bromo-2-[2-(cyanomethylamino)-2-oxoethoxy]phenyl]-2-propenoate IUPAC Name: (E)-3-[5-bromo-2-[2-(cyanomethylamino)-2-oxoethoxy]phenyl]prop-2-enoate Traditional Name: (E)-3-[5-bromo-2-[2-(cyanomethylamino)-2-keto-ethoxy]phenyl]acrylate Formula: C13H10BrN2O4- MolecularWeight: 338.1335

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Br)C=CC(=O)[O-])OCC(=O)NCC#N

Isomeric SMILES

C1=CC(=C(C=C1Br)/C=C/C(=O)[O-])OCC(=O)NCC#N

InChI

InChI=1S/C13H11BrN2O4/c14-10-2-3-11(9(7-10)1-4-13(18)19)20-8-12(17)16-6-5-15/h1-4,7H,6,8H2,(H,16,17)(H,18,19)/p-1/b4-1+