chromium(3+); methanone; 2-[2-methylsulfonyloxyethyl(phenyl)amino]ethyl methanesulfonate

Systemtic Name: chromium(3+); methanone; 2-[2-methylsulfonyloxyethyl(phenyl)amino]ethyl methanesulfonate Openeye Name: chromic; methanone; 2-[N-(2-methylsulfonyloxyethyl)anilino]ethyl methanesulfonate CAS Name: chromium(3+); methanesulfonic acid 2-[N-(2-methylsulfonyloxyethyl)anilino]ethyl ester; methanone IUPAC Name: chromium(3+); methanone; 2-[N-(2-methylsulfonyloxyethyl)anilino]ethyl methanesulfonate Traditional Name: chromic; methanesulfonic acid 2-[N-(2-methylsulfonyloxyethyl)anilino]ethyl ester; methanone Formula: C15H22CrNO9S2 MolecularWeight: 476.46258

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OCCN(CCOS(=O)(=O)C)C1=CC=CC=C1.[CH-]=O.[CH-]=O.[CH-]=O.[Cr+3]

Isomeric SMILES

CS(=O)(=O)OCCN(CCOS(=O)(=O)C)C1=CC=CC=C1.[CH-]=O.[CH-]=O.[CH-]=O.[Cr+3]

InChI

InChI=1S/C12H19NO6S2.3CHO.Cr/c1-20(14,15)18-10-8-13(9-11-19-21(2,16)17)12-6-4-3-5-7-12;3*1-2;/h3-7H,8-11H2,1-2H3;3*1H;/q;3*-1;+3