zinc; 2-(2-oxidanidylphenyl)sulfonylphenolate; propane-1,2-diamine

Systemtic Name: zinc; 2-(2-oxidanidylphenyl)sulfonylphenolate; propane-1,2-diamine Openeye Name: zinc; 2-(2-oxidophenyl)sulfonylphenolate; propane-1,2-diamine CAS Name: zinc; 2-(2-oxidophenyl)sulfonylphenolate; propane-1,2-diamine IUPAC Name: zinc; 2-(2-oxidophenyl)sulfonylphenolate; propane-1,2-diamine Traditional Name: zinc; (2-amino-1-methyl-ethyl)amine; 2-(2-oxidophenyl)sulfonylphenolate Formula: C15H18N2O4SZn MolecularWeight: 387.78842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN)N.C1=CC=C(C(=C1)[O-])S(=O)(=O)C2=CC=CC=C2[O-].[Zn+2]

Isomeric SMILES

CC(CN)N.C1=CC=C(C(=C1)[O-])S(=O)(=O)C2=CC=CC=C2[O-].[Zn+2]

InChI

InChI=1S/C12H10O4S.C3H10N2.Zn/c13-9-5-1-3-7-11(9)17(15,16)12-8-4-2-6-10(12)14;1-3(5)2-4;/h1-8,13-14H;3H,2,4-5H2,1H3;/q;;+2/p-2