2-chloranyl-6-morpholin-4-yl-benzenediazonium; 4-methylbenzenesulfonate

Systemtic Name: 2-chloranyl-6-morpholin-4-yl-benzenediazonium; 4-methylbenzenesulfonate Openeye Name: 2-chloro-6-morpholino-benzenediazonium; 4-methylbenzenesulfonate CAS Name: 2-chloro-6-(4-morpholinyl)benzenediazonium; 4-methylbenzenesulfonate IUPAC Name: 2-chloro-6-morpholin-4-ylbenzenediazonium; 4-methylbenzenesulfonate Traditional Name: 2-chloro-6-morpholino-benzenediazonium tosylate Formula: C17H18ClN3O4S MolecularWeight: 395.86052

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1COCCN1C2=C(C(=CC=C2)Cl)[N+]#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1COCCN1C2=C(C(=CC=C2)Cl)[N+]#N

InChI

InChI=1S/C10H11ClN3O.C7H8O3S/c11-8-2-1-3-9(10(8)13-12)14-4-6-15-7-5-14;1-6-2-4-7(5-3-6)11(8,9)10/h1-3H,4-7H2;2-5H,1H3,(H,8,9,10)/q+1;/p-1