(E)-3-[4-(2-methylprop-2-enoxy)-3-nitro-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-(2-methylprop-2-enoxy)-3-nitro-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-(2-methylallyloxy)-3-nitro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-(2-methylprop-2-enoxy)-3-nitrophenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-(2-methylprop-2-enoxy)-3-nitrophenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-(2-methylallyloxy)-3-nitro-phenyl]acrylic acid Formula: C13H13NO5 MolecularWeight: 263.24602

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)COC1=C(C=C(C=C1)C=CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(=C)COC1=C(C=C(C=C1)/C=C/C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H13NO5/c1-9(2)8-19-12-5-3-10(4-6-13(15)16)7-11(12)14(17)18/h3-7H,1,8H2,2H3,(H,15,16)/b6-4+