potassium 1-[7-imidazol-1-yl-2-(4-sulfinatophenyl)nonan-4-yl]pyrrolidin-2-one

Systemtic Name: potassium 1-[7-imidazol-1-yl-2-(4-sulfinatophenyl)nonan-4-yl]pyrrolidin-2-one Openeye Name: potassium 1-[4-imidazol-1-yl-1-[2-(4-sulfinatophenyl)propyl]hexyl]pyrrolidin-2-one CAS Name: potassium 1-[7-(1-imidazolyl)-2-(4-sulfinatophenyl)nonan-4-yl]-2-pyrrolidinone IUPAC Name: potassium 1-[7-imidazol-1-yl-2-(4-sulfinatophenyl)nonan-4-yl]pyrrolidin-2-one Traditional Name: potassium 1-[4-imidazol-1-yl-1-[2-(4-sulfinatophenyl)propyl]hexyl]-2-pyrrolidone Formula: C22H30KN3O3S MolecularWeight: 455.6552

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(CC(C)C1=CC=C(C=C1)[S-](=O)=O)N2CCCC2=O)N3C=CN=C3.[K+]

Isomeric SMILES

CCC(CCC(CC(C)C1=CC=C(C=C1)[S-](=O)=O)N2CCCC2=O)N3C=CN=C3.[K+]

InChI

InChI=1S/C22H30N3O3S.K/c1-3-19(24-14-12-23-16-24)8-9-20(25-13-4-5-22(25)26)15-17(2)18-6-10-21(11-7-18)29(27)28;/h6-7,10-12,14,16-17,19-20H,3-5,8-9,13,15H2,1-2H3;/q-1;+1