(E)-3-[2-nitro-4,5-bis(oxidanyl)phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-nitro-4,5-bis(oxidanyl)phenyl]prop-2-enoic acid Openeye Name: (E)-3-(4,5-dihydroxy-2-nitro-phenyl)prop-2-enoic acid CAS Name: (E)-3-(4,5-dihydroxy-2-nitrophenyl)-2-propenoic acid IUPAC Name: (E)-3-(4,5-dihydroxy-2-nitrophenyl)prop-2-enoic acid Traditional Name: (E)-3-(4,5-dihydroxy-2-nitro-phenyl)acrylic acid Formula: C9H7NO6 MolecularWeight: 225.15498

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=CC(=C1O)O)[N+](=O)[O-])C=CC(=O)O

Isomeric SMILES

C1=C(C(=CC(=C1O)O)[N+](=O)[O-])/C=C/C(=O)O

InChI

InChI=1S/C9H7NO6/c11-7-3-5(1-2-9(13)14)6(10(15)16)4-8(7)12/h1-4,11-12H,(H,13,14)/b2-1+