potassium 1-[3-imidazol-1-yl-7-(4-sulfinatophenyl)nonan-5-yl]pyrrolidin-2-one

Systemtic Name: potassium 1-[3-imidazol-1-yl-7-(4-sulfinatophenyl)nonan-5-yl]pyrrolidin-2-one Openeye Name: potassium 1-[1-(2-imidazol-1-ylbutyl)-3-(4-sulfinatophenyl)pentyl]pyrrolidin-2-one CAS Name: potassium 1-[3-(1-imidazolyl)-7-(4-sulfinatophenyl)nonan-5-yl]-2-pyrrolidinone IUPAC Name: potassium 1-[3-imidazol-1-yl-7-(4-sulfinatophenyl)nonan-5-yl]pyrrolidin-2-one Traditional Name: potassium 1-[1-(2-imidazol-1-ylbutyl)-3-(4-sulfinatophenyl)pentyl]-2-pyrrolidone Formula: C22H30KN3O3S MolecularWeight: 455.6552

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(CC(CC)N1C=CN=C1)N2CCCC2=O)C3=CC=C(C=C3)[S-](=O)=O.[K+]

Isomeric SMILES

CCC(CC(CC(CC)N1C=CN=C1)N2CCCC2=O)C3=CC=C(C=C3)[S-](=O)=O.[K+]

InChI

InChI=1S/C22H30N3O3S.K/c1-3-17(18-7-9-21(10-8-18)29(27)28)14-20(25-12-5-6-22(25)26)15-19(4-2)24-13-11-23-16-24;/h7-11,13,16-17,19-20H,3-6,12,14-15H2,1-2H3;/q-1;+1