5-azanyl-2-(4-azanyl-2-sulfo-phenyl)-3,4-dimethyl-benzenesulfonic acid

Systemtic Name: 5-azanyl-2-(4-azanyl-2-sulfo-phenyl)-3,4-dimethyl-benzenesulfonic acid Openeye Name: 5-amino-2-(4-amino-2-sulfo-phenyl)-3,4-dimethyl-benzenesulfonic acid CAS Name: 5-amino-2-(4-amino-2-sulfophenyl)-3,4-dimethylbenzenesulfonic acid IUPAC Name: 5-amino-2-(4-amino-2-sulfophenyl)-3,4-dimethylbenzenesulfonic acid Traditional Name: 5-amino-2-(4-amino-2-sulfo-phenyl)-3,4-dimethyl-besylic acid Formula: C14H16N2O6S2 MolecularWeight: 372.41664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1N)S(=O)(=O)O)C2=C(C=C(C=C2)N)S(=O)(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C=C1N)S(=O)(=O)O)C2=C(C=C(C=C2)N)S(=O)(=O)O)C

InChI

InChI=1S/C14H16N2O6S2/c1-7-8(2)14(13(6-11(7)16)24(20,21)22)10-4-3-9(15)5-12(10)23(17,18)19/h3-6H,15-16H2,1-2H3,(H,17,18,19)(H,20,21,22)