(E)-3-[2-(3-azanyl-2-methyl-3-oxidanylidene-propoxy)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(3-azanyl-2-methyl-3-oxidanylidene-propoxy)phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(3-amino-2-methyl-3-oxo-propoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(3-amino-2-methyl-3-oxopropoxy)phenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(3-amino-2-methyl-3-oxopropoxy)phenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(3-amino-3-keto-2-methyl-propoxy)phenyl]acrylic acid Formula: C13H15NO4 MolecularWeight: 249.2625

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1C=CC(=O)O)C(=O)N

Isomeric SMILES

CC(COC1=CC=CC=C1/C=C/C(=O)O)C(=O)N

InChI

InChI=1S/C13H15NO4/c1-9(13(14)17)8-18-11-5-3-2-4-10(11)6-7-12(15)16/h2-7,9H,8H2,1H3,(H2,14,17)(H,15,16)/b7-6+