(E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3,5-dimethyl-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3,5-dimethyl-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-amino-2-oxo-ethoxy)-3,5-dimethyl-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(2-amino-2-oxoethoxy)-3,5-dimethylphenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-amino-2-oxoethoxy)-3,5-dimethylphenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-amino-2-keto-ethoxy)-3,5-dimethyl-phenyl]acrylic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)N)C)C=CC(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N)C)/C=C/C(=O)O

InChI

InChI=1S/C13H15NO4/c1-8-5-10(3-4-12(16)17)6-9(2)13(8)18-7-11(14)15/h3-6H,7H2,1-2H3,(H2,14,15)(H,16,17)/b4-3+