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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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