4-chloranyl-3-methyl-benzenediazonium; 5-sulfonaphthalene-1-sulfonate

Systemtic Name: 4-chloranyl-3-methyl-benzenediazonium; 5-sulfonaphthalene-1-sulfonate Openeye Name: 4-chloro-3-methyl-benzenediazonium; 5-sulfonaphthalene-1-sulfonate CAS Name: 4-chloro-3-methylbenzenediazonium; 5-sulfo-1-naphthalenesulfonate IUPAC Name: 4-chloro-3-methylbenzenediazonium; 5-sulfonaphthalene-1-sulfonate Traditional Name: 4-chloro-3-methyl-benzenediazonium; 5-sulfonaphthalene-1-sulfonate Formula: C17H13ClN2O6S2 MolecularWeight: 440.87792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+]#N)Cl.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)[N+]#N)Cl.C1=CC2=C(C=CC=C2S(=O)(=O)[O-])C(=C1)S(=O)(=O)O

InChI

InChI=1S/C10H8O6S2.C7H6ClN2/c11-17(12,13)9-5-1-3-7-8(9)4-2-6-10(7)18(14,15)16;1-5-4-6(10-9)2-3-7(5)8/h1-6H,(H,11,12,13)(H,14,15,16);2-4H,1H3/q;+1/p-1