(E)-3-[5-bromanyl-2-[1-(methylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-bromanyl-2-[1-(methylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[5-bromo-2-[1-methyl-2-(methylamino)-2-oxo-ethoxy]phenyl]prop-2-enoic acid CAS Name: (E)-3-[5-bromo-2-[1-(methylamino)-1-oxopropan-2-yl]oxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[5-bromo-2-[1-(methylamino)-1-oxopropan-2-yl]oxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[5-bromo-2-[2-keto-1-methyl-2-(methylamino)ethoxy]phenyl]acrylic acid Formula: C13H14BrNO4 MolecularWeight: 328.15856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)OC1=C(C=C(C=C1)Br)C=CC(=O)O

Isomeric SMILES

CC(C(=O)NC)OC1=C(C=C(C=C1)Br)/C=C/C(=O)O

InChI

InChI=1S/C13H14BrNO4/c1-8(13(18)15-2)19-11-5-4-10(14)7-9(11)3-6-12(16)17/h3-8H,1-2H3,(H,15,18)(H,16,17)/b6-3+