(E)-3-[3-bromanyl-5-methoxy-4-[1-(methylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[3-bromanyl-5-methoxy-4-[1-(methylamino)-1-oxidanylidene-propan-2-yl]oxy-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[3-bromo-5-methoxy-4-[1-methyl-2-(methylamino)-2-oxo-ethoxy]phenyl]prop-2-enoic acid CAS Name: (E)-3-[3-bromo-5-methoxy-4-[1-(methylamino)-1-oxopropan-2-yl]oxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[3-bromo-5-methoxy-4-[1-(methylamino)-1-oxopropan-2-yl]oxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[3-bromo-4-[2-keto-1-methyl-2-(methylamino)ethoxy]-5-methoxy-phenyl]acrylic acid Formula: C14H16BrNO5 MolecularWeight: 358.18454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)OC1=C(C=C(C=C1Br)C=CC(=O)O)OC

Isomeric SMILES

CC(C(=O)NC)OC1=C(C=C(C=C1Br)/C=C/C(=O)O)OC

InChI

InChI=1S/C14H16BrNO5/c1-8(14(19)16-2)21-13-10(15)6-9(4-5-12(17)18)7-11(13)20-3/h4-8H,1-3H3,(H,16,19)(H,17,18)/b5-4+