(E)-3-(2-acetamido-4-nitro-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-acetamido-4-nitro-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(2-acetamido-4-nitro-phenyl)prop-2-enoic acid CAS Name: (E)-3-(2-acetamido-4-nitrophenyl)-2-propenoic acid IUPAC Name: (E)-3-(2-acetamido-4-nitrophenyl)prop-2-enoic acid Traditional Name: (E)-3-(2-acetamido-4-nitro-phenyl)acrylic acid Formula: C11H10N2O5 MolecularWeight: 250.2075

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C=CC(=O)O

Isomeric SMILES

CC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])/C=C/C(=O)O

InChI

InChI=1S/C11H10N2O5/c1-7(14)12-10-6-9(13(17)18)4-2-8(10)3-5-11(15)16/h2-6H,1H3,(H,12,14)(H,15,16)/b5-3+