(E)-3-[2-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-5-nitro-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-[2-(dimethylamino)-2-oxidanylidene-ethoxy]-5-nitro-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-[2-(dimethylamino)-2-oxo-ethoxy]-5-nitro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-[2-(dimethylamino)-2-oxoethoxy]-5-nitrophenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-[2-(dimethylamino)-2-oxoethoxy]-5-nitrophenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-[2-(dimethylamino)-2-keto-ethoxy]-5-nitro-phenyl]acrylic acid Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O6/c1-14(2)12(16)8-21-11-5-4-10(15(19)20)7-9(11)3-6-13(17)18/h3-7H,8H2,1-2H3,(H,17,18)/b6-3+