(E)-2-methyl-3-(2,4,6-trinitrophenyl)prop-2-enoate

Systemtic Name: (E)-2-methyl-3-(2,4,6-trinitrophenyl)prop-2-enoate Openeye Name: (E)-2-methyl-3-(2,4,6-trinitrophenyl)prop-2-enoate CAS Name: (E)-2-methyl-3-(2,4,6-trinitrophenyl)-2-propenoate IUPAC Name: (E)-2-methyl-3-(2,4,6-trinitrophenyl)prop-2-enoate Traditional Name: (E)-2-methyl-3-picryl-acrylate Formula: C10H6N3O8- MolecularWeight: 296.16994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H7N3O8/c1-5(10(14)15)2-7-8(12(18)19)3-6(11(16)17)4-9(7)13(20)21/h2-4H,1H3,(H,14,15)/p-1/b5-2+