(E)-2-acetamido-3-(2,4-dinitrophenyl)prop-2-enoic acid

Systemtic Name: (E)-2-acetamido-3-(2,4-dinitrophenyl)prop-2-enoic acid Openeye Name: (E)-2-acetamido-3-(2,4-dinitrophenyl)prop-2-enoic acid CAS Name: (E)-2-acetamido-3-(2,4-dinitrophenyl)-2-propenoic acid IUPAC Name: (E)-2-acetamido-3-(2,4-dinitrophenyl)prop-2-enoic acid Traditional Name: (E)-2-acetamido-3-(2,4-dinitrophenyl)acrylic acid Formula: C11H9N3O7 MolecularWeight: 295.20506

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H9N3O7/c1-6(15)12-9(11(16)17)4-7-2-3-8(13(18)19)5-10(7)14(20)21/h2-5H,1H3,(H,12,15)(H,16,17)/b9-4+