2-[diazonio-[3-methoxy-5-methyl-2-[4-(2-methyl-3-oxidanyl-propyl)phenyl]pyran-2-yl]amino]-3-sulfamoyl-pyridine

Systemtic Name: 2-[diazonio-[3-methoxy-5-methyl-2-[4-(2-methyl-3-oxidanyl-propyl)phenyl]pyran-2-yl]amino]-3-sulfamoyl-pyridine Openeye Name: 2-[diazonio-[2-[4-(3-hydroxy-2-methyl-propyl)phenyl]-3-methoxy-5-methyl-pyran-2-yl]amino]-3-sulfamoyl-pyridine CAS Name: 2-[diazonio-[2-[4-(3-hydroxy-2-methylpropyl)phenyl]-3-methoxy-5-methyl-2-pyranyl]amino]-3-sulfamoylpyridine IUPAC Name: 2-[diazonio-[2-[4-(3-hydroxy-2-methylpropyl)phenyl]-3-methoxy-5-methylpyran-2-yl]amino]-3-sulfamoylpyridine Traditional Name: 2-[diazonio-[2-[4-(3-hydroxy-2-methyl-propyl)phenyl]-3-methoxy-5-methyl-pyran-2-yl]amino]-3-sulfamoyl-pyridine Formula: C22H26N5O5S+ MolecularWeight: 472.53734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=COC(C(=C1)OC)(C2=CC=C(C=C2)CC(C)CO)N(C3=C(C=CC=N3)S(=O)(=O)N)[N+]#N

Isomeric SMILES

CC1=COC(C(=C1)OC)(C2=CC=C(C=C2)CC(C)CO)N(C3=C(C=CC=N3)S(=O)(=O)N)[N+]#N

InChI

InChI=1S/C22H26N5O5S/c1-15(13-28)11-17-6-8-18(9-7-17)22(20(31-3)12-16(2)14-32-22)27(26-23)21-19(33(24,29)30)5-4-10-25-21/h4-10,12,14-15,28H,11,13H2,1-3H3,(H2,24,29,30)/q+1