4-[(4-azanyl-5-methoxy-2-methyl-phenyl)diazenyl]-5-(phenylsulfonyloxy)naphthalene-2,7-disulfonic acid

Systemtic Name: 4-[(4-azanyl-5-methoxy-2-methyl-phenyl)diazenyl]-5-(phenylsulfonyloxy)naphthalene-2,7-disulfonic acid Openeye Name: 4-(4-amino-5-methoxy-2-methyl-phenyl)azo-5-(benzenesulfonyloxy)naphthalene-2,7-disulfonic acid CAS Name: 4-(4-amino-5-methoxy-2-methylphenyl)azo-5-(benzenesulfonyloxy)naphthalene-2,7-disulfonic acid IUPAC Name: 4-[(4-amino-5-methoxy-2-methylphenyl)diazenyl]-5-(benzenesulfonyloxy)naphthalene-2,7-disulfonic acid Traditional Name: 4-(4-amino-5-methoxy-2-methyl-phenyl)azo-5-besyloxy-naphthalene-2,7-disulfonic acid Formula: C24H21N3O10S3 MolecularWeight: 607.63264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)O)OC)N

Isomeric SMILES

CC1=CC(=C(C=C1N=NC2=C3C(=CC(=C2)S(=O)(=O)O)C=C(C=C3OS(=O)(=O)C4=CC=CC=C4)S(=O)(=O)O)OC)N

InChI

InChI=1S/C24H21N3O10S3/c1-14-8-19(25)22(36-2)13-20(14)26-27-21-11-17(38(28,29)30)9-15-10-18(39(31,32)33)12-23(24(15)21)37-40(34,35)16-6-4-3-5-7-16/h3-13H,25H2,1-2H3,(H,28,29,30)(H,31,32,33)