(Z)-2-methyl-3-(2,4,5-trimethyl-3,6-dinitro-phenyl)prop-2-enoic acid

Systemtic Name: (Z)-2-methyl-3-(2,4,5-trimethyl-3,6-dinitro-phenyl)prop-2-enoic acid Openeye Name: (Z)-2-methyl-3-(2,4,5-trimethyl-3,6-dinitro-phenyl)prop-2-enoic acid CAS Name: (Z)-2-methyl-3-(2,4,5-trimethyl-3,6-dinitrophenyl)-2-propenoic acid IUPAC Name: (Z)-2-methyl-3-(2,4,5-trimethyl-3,6-dinitrophenyl)prop-2-enoic acid Traditional Name: (Z)-2-methyl-3-(2,4,5-trimethyl-3,6-dinitro-phenyl)acrylic acid Formula: C13H14N2O6 MolecularWeight: 294.26006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14N2O6/c1-6(13(16)17)5-10-9(4)11(14(18)19)7(2)8(3)12(10)15(20)21/h5H,1-4H3,(H,16,17)/b6-5-