2,5-dibutoxy-4-(4-ethoxyphenyl)-3-sulfanyl-benzenediazonium

Systemtic Name: 2,5-dibutoxy-4-(4-ethoxyphenyl)-3-sulfanyl-benzenediazonium Openeye Name: 2,5-dibutoxy-4-(4-ethoxyphenyl)-3-sulfanyl-benzenediazonium CAS Name: 2,5-dibutoxy-4-(4-ethoxyphenyl)-3-mercaptobenzenediazonium IUPAC Name: 2,5-dibutoxy-4-(4-ethoxyphenyl)-3-sulfanylbenzenediazonium Traditional Name: 2,5-dibutoxy-3-mercapto-4-p-phenetyl-benzenediazonium Formula: C22H29N2O3S+ MolecularWeight: 401.54226

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=C(C(=C1)[N+]#N)OCCCC)S)C2=CC=C(C=C2)OCC

Isomeric SMILES

CCCCOC1=C(C(=C(C(=C1)[N+]#N)OCCCC)S)C2=CC=C(C=C2)OCC

InChI

InChI=1S/C22H28N2O3S/c1-4-7-13-26-19-15-18(24-23)21(27-14-8-5-2)22(28)20(19)16-9-11-17(12-10-16)25-6-3/h9-12,15H,4-8,13-14H2,1-3H3/p+1