3-[(3-nitro-5-sulfonato-phenyl)carbonylamino]-5-sulfonato-benzoate

Systemtic Name: 3-[(3-nitro-5-sulfonato-phenyl)carbonylamino]-5-sulfonato-benzoate Openeye Name: 3-[(3-nitro-5-sulfonato-benzoyl)amino]-5-sulfonato-benzoate CAS Name: 3-[[(3-nitro-5-sulfonatophenyl)-oxomethyl]amino]-5-sulfonatobenzoate IUPAC Name: 3-[(3-nitro-5-sulfonatobenzoyl)amino]-5-sulfonatobenzoate Traditional Name: 3-[(3-nitro-5-sulfonato-benzoyl)amino]-5-sulfonato-benzoate Formula: C14H7N2O11S2-3 MolecularWeight: 443.34218

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1NC(=O)C2=CC(=CC(=C2)S(=O)(=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=C(C=C(C=C1NC(=O)C2=CC(=CC(=C2)S(=O)(=O)[O-])[N+](=O)[O-])S(=O)(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H10N2O11S2/c17-13(7-2-10(16(20)21)6-12(3-7)29(25,26)27)15-9-1-8(14(18)19)4-11(5-9)28(22,23)24/h1-6H,(H,15,17)(H,18,19)(H,22,23,24)(H,25,26,27)/p-3