(E)-3-[4-(1-azanyl-1-oxidanylidene-propan-2-yl)oxyphenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(1-azanyl-1-oxidanylidene-propan-2-yl)oxyphenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-amino-1-methyl-2-oxo-ethoxy)phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(1-amino-1-oxopropan-2-yl)oxyphenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(1-amino-1-oxopropan-2-yl)oxyphenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-amino-2-keto-1-methyl-ethoxy)phenyl]acrylic acid Formula: C12H13NO4 MolecularWeight: 235.23592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N)OC1=CC=C(C=C1)C=CC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C12H13NO4/c1-8(12(13)16)17-10-5-2-9(3-6-10)4-7-11(14)15/h2-8H,1H3,(H2,13,16)(H,14,15)/b7-4+