2-methoxy-4-nitro-benzenediazonium; naphthalene-1,5-disulfonate

Systemtic Name: 2-methoxy-4-nitro-benzenediazonium; naphthalene-1,5-disulfonate Openeye Name: 2-methoxy-4-nitro-benzenediazonium; naphthalene-1,5-disulfonate CAS Name: 2-methoxy-4-nitrobenzenediazonium; naphthalene-1,5-disulfonate IUPAC Name: 2-methoxy-4-nitrobenzenediazonium; naphthalene-1,5-disulfonate Traditional Name: 2-methoxy-4-nitro-benzenediazonium; naphthalene-1,5-disulfonate Formula: C24H18N6O12S2 MolecularWeight: 646.56272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N.COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N.COC1=C(C=CC(=C1)[N+](=O)[O-])[N+]#N.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C10H8O6S2.2C7H6N3O3/c11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16;2*1-13-7-4-5(10(11)12)2-3-6(7)9-8/h1-6H,(H,11,12,13)(H,14,15,16);2*2-4H,1H3/q;2*+1/p-2