(E)-3-(2,4-dimethyl-3,5-dinitro-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(2,4-dimethyl-3,5-dinitro-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(2,4-dimethyl-3,5-dinitro-phenyl)prop-2-enoic acid CAS Name: (E)-3-(2,4-dimethyl-3,5-dinitrophenyl)-2-propenoic acid IUPAC Name: (E)-3-(2,4-dimethyl-3,5-dinitrophenyl)prop-2-enoic acid Traditional Name: (E)-3-(2,4-dimethyl-3,5-dinitro-phenyl)acrylic acid Formula: C11H10N2O6 MolecularWeight: 266.2069

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C=CC(=O)O)[N+](=O)[O-])C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1/C=C/C(=O)O)[N+](=O)[O-])C)[N+](=O)[O-]

InChI

InChI=1S/C11H10N2O6/c1-6-8(3-4-10(14)15)5-9(12(16)17)7(2)11(6)13(18)19/h3-5H,1-2H3,(H,14,15)/b4-3+