4-[(3-nitrophenyl)carbonylamino]-5-oxidanyl-naphthalene-1,7-disulfonic acid

Systemtic Name: 4-[(3-nitrophenyl)carbonylamino]-5-oxidanyl-naphthalene-1,7-disulfonic acid Openeye Name: 5-hydroxy-4-[(3-nitrobenzoyl)amino]naphthalene-1,7-disulfonic acid CAS Name: 5-hydroxy-4-[[(3-nitrophenyl)-oxomethyl]amino]naphthalene-1,7-disulfonic acid IUPAC Name: 5-hydroxy-4-[(3-nitrobenzoyl)amino]naphthalene-1,7-disulfonic acid Traditional Name: 5-hydroxy-4-[(3-nitrobenzoyl)amino]naphthalene-1,7-disulfonic acid Formula: C17H12N2O10S2 MolecularWeight: 468.41458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=C3C(=CC(=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=C3C(=CC(=CC3=C(C=C2)S(=O)(=O)O)S(=O)(=O)O)O

InChI

InChI=1S/C17H12N2O10S2/c20-14-8-11(30(24,25)26)7-12-15(31(27,28)29)5-4-13(16(12)14)18-17(21)9-2-1-3-10(6-9)19(22)23/h1-8,20H,(H,18,21)(H,24,25,26)(H,27,28,29)