(E)-3-[2-[1-(methylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-[1-(methylamino)-1-oxidanylidene-propan-2-yl]oxyphenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-[1-methyl-2-(methylamino)-2-oxo-ethoxy]phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-[1-(methylamino)-1-oxopropan-2-yl]oxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-[1-(methylamino)-1-oxopropan-2-yl]oxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-[2-keto-1-methyl-2-(methylamino)ethoxy]phenyl]acrylic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC)OC1=CC=CC=C1C=CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO4/c1-9(13(17)14-2)18-11-6-4-3-5-10(11)7-8-12(15)16/h3-9H,1-2H3,(H,14,17)(H,15,16)/b8-7+