2-methoxy-5-[1-[4-(2-methylbutan-2-yl)phenoxy]ethylcarbamoyl]benzenediazonium; naphthalene-1-sulfonate

Systemtic Name: 2-methoxy-5-[1-[4-(2-methylbutan-2-yl)phenoxy]ethylcarbamoyl]benzenediazonium; naphthalene-1-sulfonate Openeye Name: 5-[1-[4-(1,1-dimethylpropyl)phenoxy]ethylcarbamoyl]-2-methoxy-benzenediazonium; naphthalene-1-sulfonate CAS Name: 2-methoxy-5-[[1-[4-(2-methylbutan-2-yl)phenoxy]ethylamino]-oxomethyl]benzenediazonium; 1-naphthalenesulfonate IUPAC Name: 2-methoxy-5-[1-[4-(2-methylbutan-2-yl)phenoxy]ethylcarbamoyl]benzenediazonium; naphthalene-1-sulfonate Traditional Name: 5-[1-(4-tert-amylphenoxy)ethylcarbamoyl]-2-methoxy-benzenediazonium; naphthalene-1-sulfonate Formula: C31H33N3O6S MolecularWeight: 575.67522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OC(C)NC(=O)C2=CC(=C(C=C2)OC)[N+]#N.C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)[O-]

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OC(C)NC(=O)C2=CC(=C(C=C2)OC)[N+]#N.C1=CC=C2C(=C1)C=CC=C2S(=O)(=O)[O-]

InChI

InChI=1S/C21H25N3O3.C10H8O3S/c1-6-21(3,4)16-8-10-17(11-9-16)27-14(2)23-20(25)15-7-12-19(26-5)18(13-15)24-22;11-14(12,13)10-7-3-5-8-4-1-2-6-9(8)10/h7-14H,6H2,1-5H3;1-7H,(H,11,12,13)