3-chloranyl-4-[(6-methyl-1-oxidanyl-2,3,1-benzodiazaborinin-2-yl)sulfonyl]aniline

Systemtic Name: 3-chloranyl-4-[(6-methyl-1-oxidanyl-2,3,1-benzodiazaborinin-2-yl)sulfonyl]aniline Openeye Name: 3-chloro-4-[(1-hydroxy-6-methyl-2,3,1-benzodiazaborinin-2-yl)sulfonyl]aniline CAS Name: 3-chloro-4-[(1-hydroxy-6-methyl-2,3,1-benzodiazaborin-2-yl)sulfonyl]aniline IUPAC Name: 3-chloro-4-[(1-hydroxy-6-methyl-2,3,1-benzodiazaborinin-2-yl)sulfonyl]aniline Traditional Name: [3-chloro-4-[(1-hydroxy-6-methyl-2,3,1-benzodiazaborin-2-yl)sulfonyl]phenyl]amine Formula: C14H13BClN3O3S MolecularWeight: 349.60032

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Descriptors Computed from Structure

Canonical SMILES:

B1(C2=C(C=C(C=C2)C)C=NN1S(=O)(=O)C3=C(C=C(C=C3)N)Cl)O

Isomeric SMILES

B1(C2=C(C=C(C=C2)C)C=NN1S(=O)(=O)C3=C(C=C(C=C3)N)Cl)O

InChI

InChI=1S/C14H13BClN3O3S/c1-9-2-4-12-10(6-9)8-18-19(15(12)20)23(21,22)14-5-3-11(17)7-13(14)16/h2-8,20H,17H2,1H3