2,5-diethoxy-4-sulfanyl-benzenediazonium; methoxybenzene; sulfate

Systemtic Name: 2,5-diethoxy-4-sulfanyl-benzenediazonium; methoxybenzene; sulfate Openeye Name: anisole; 2,5-diethoxy-4-sulfanyl-benzenediazonium; sulfate CAS Name: 2,5-diethoxy-4-mercaptobenzenediazonium; methoxybenzene; sulfate IUPAC Name: anisole; 2,5-diethoxy-4-sulfanylbenzenediazonium; sulfate Traditional Name: anisole; 2,5-diethoxy-4-mercapto-benzenediazonium; sulfate Formula: C17H21N2O7S2- MolecularWeight: 429.48784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1[N+]#N)OCC)S.COC1=CC=CC=C1.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1[N+]#N)OCC)S.COC1=CC=CC=C1.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C10H12N2O2S.C7H8O.H2O4S/c1-3-13-8-6-10(15)9(14-4-2)5-7(8)12-11;1-8-7-5-3-2-4-6-7;1-5(2,3)4/h5-6H,3-4H2,1-2H3;2-6H,1H3;(H2,1,2,3,4)/p-1