4-azanyl-3-(1,3-benzoxazol-2-yl)benzenesulfonic acid

Systemtic Name: 4-azanyl-3-(1,3-benzoxazol-2-yl)benzenesulfonic acid Openeye Name: 4-amino-3-(1,3-benzoxazol-2-yl)benzenesulfonic acid CAS Name: 4-amino-3-(1,3-benzoxazol-2-yl)benzenesulfonic acid IUPAC Name: 4-amino-3-(1,3-benzoxazol-2-yl)benzenesulfonic acid Traditional Name: 4-amino-3-(1,3-benzoxazol-2-yl)besylic acid Formula: C13H10N2O4S MolecularWeight: 290.2945

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)S(=O)(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)C3=C(C=CC(=C3)S(=O)(=O)O)N

InChI

InChI=1S/C13H10N2O4S/c14-10-6-5-8(20(16,17)18)7-9(10)13-15-11-3-1-2-4-12(11)19-13/h1-7H,14H2,(H,16,17,18)