[benzotriazol-1-ylmethyl(methyl)amino] benzenesulfinate

Systemtic Name: [benzotriazol-1-ylmethyl(methyl)amino] benzenesulfinate Openeye Name: [benzotriazol-1-ylmethyl(methyl)amino] benzenesulfinate CAS Name: benzenesulfinic acid [1-benzotriazolylmethyl(methyl)amino] ester IUPAC Name: [benzotriazol-1-ylmethyl(methyl)amino] benzenesulfinate Traditional Name: benzenesulfinic acid [benzotriazol-1-ylmethyl(methyl)amino] ester Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

CN(CN1C2=CC=CC=C2N=N1)OS(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CN1C2=CC=CC=C2N=N1)O[S@](=O)C3=CC=CC=C3

InChI

InChI=1S/C14H14N4O2S/c1-17(20-21(19)12-7-3-2-4-8-12)11-18-14-10-6-5-9-13(14)15-16-18/h2-10H,11H2,1H3/t21-/m0/s1