benzene; 3-ethoxy-5-methoxy-1-(4-methylphenyl)sulfonyl-2-oxidanidyl-4-phenyl-indazol-2-ium

Systemtic Name: benzene; 3-ethoxy-5-methoxy-1-(4-methylphenyl)sulfonyl-2-oxidanidyl-4-phenyl-indazol-2-ium Openeye Name: benzene; 3-ethoxy-5-methoxy-2-oxido-4-phenyl-1-(p-tolylsulfonyl)indazol-2-ium CAS Name: benzene; 3-ethoxy-5-methoxy-1-(4-methylphenyl)sulfonyl-2-oxido-4-phenylindazol-2-ium IUPAC Name: benzene; 3-ethoxy-5-methoxy-1-(4-methylphenyl)sulfonyl-2-oxido-4-phenylindazol-2-ium Traditional Name: benzene; 3-ethoxy-5-methoxy-2-oxido-4-phenyl-1-tosyl-indazol-2-ium Formula: C29H28N2O5S MolecularWeight: 516.60802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=[N+](N(C2=C1C(=C(C=C2)OC)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C)[O-].C1=CC=CC=C1

Isomeric SMILES

CCOC1=[N+](N(C2=C1C(=C(C=C2)OC)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)C)[O-].C1=CC=CC=C1

InChI

InChI=1S/C23H22N2O5S.C6H6/c1-4-30-23-22-19(14-15-20(29-3)21(22)17-8-6-5-7-9-17)25(24(23)26)31(27,28)18-12-10-16(2)11-13-18;1-2-4-6-5-3-1/h5-15H,4H2,1-3H3;1-6H