5-azanyl-2-[(3-azanyl-4-methyl-phenyl)amino]benzenesulfonic acid

Systemtic Name: 5-azanyl-2-[(3-azanyl-4-methyl-phenyl)amino]benzenesulfonic acid Openeye Name: 5-amino-2-(3-amino-4-methyl-anilino)benzenesulfonic acid CAS Name: 5-amino-2-(3-amino-4-methylanilino)benzenesulfonic acid IUPAC Name: 5-amino-2-(3-amino-4-methylanilino)benzenesulfonic acid Traditional Name: 5-amino-2-(3-amino-4-methyl-anilino)besylic acid Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)N)S(=O)(=O)O)N

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C(C=C(C=C2)N)S(=O)(=O)O)N

InChI

InChI=1S/C13H15N3O3S/c1-8-2-4-10(7-11(8)15)16-12-5-3-9(14)6-13(12)20(17,18)19/h2-7,16H,14-15H2,1H3,(H,17,18,19)