2-azanyl-3-(3,5-dimethylphenyl)benzenesulfonic acid

Systemtic Name: 2-azanyl-3-(3,5-dimethylphenyl)benzenesulfonic acid Openeye Name: 2-amino-3-(3,5-dimethylphenyl)benzenesulfonic acid CAS Name: 2-amino-3-(3,5-dimethylphenyl)benzenesulfonic acid IUPAC Name: 2-amino-3-(3,5-dimethylphenyl)benzenesulfonic acid Traditional Name: 2-amino-3-(3,5-dimethylphenyl)besylic acid Formula: C14H15NO3S MolecularWeight: 277.3388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO3S/c1-9-6-10(2)8-11(7-9)12-4-3-5-13(14(12)15)19(16,17)18/h3-8H,15H2,1-2H3,(H,16,17,18)