2-azanyl-4-methyl-5-phenoxysulfonyl-benzenesulfonic acid

Systemtic Name: 2-azanyl-4-methyl-5-phenoxysulfonyl-benzenesulfonic acid Openeye Name: 2-amino-4-methyl-5-phenoxysulfonyl-benzenesulfonic acid CAS Name: 2-amino-4-methyl-5-phenoxysulfonylbenzenesulfonic acid IUPAC Name: 2-amino-4-methyl-5-phenoxysulfonylbenzenesulfonic acid Traditional Name: 2-amino-4-methyl-5-phenoxysulfonyl-besylic acid Formula: C13H13NO6S2 MolecularWeight: 343.37542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1S(=O)(=O)OC2=CC=CC=C2)S(=O)(=O)O)N

Isomeric SMILES

CC1=CC(=C(C=C1S(=O)(=O)OC2=CC=CC=C2)S(=O)(=O)O)N

InChI

InChI=1S/C13H13NO6S2/c1-9-7-11(14)13(21(15,16)17)8-12(9)22(18,19)20-10-5-3-2-4-6-10/h2-8H,14H2,1H3,(H,15,16,17)