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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1C=CC(=O)O)[N+](=O)[O-])O)O

Isomeric SMILES

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

InChI

InChI=1S/C9H7NO6/c11-6-3-1-5(2-4-7(12)13)8(9(6)14)10(15)16/h1-4,11,14H,(H,12,13)/b4-2+