1-(2-butoxy-1-sulfinatooxy-pyrrolidin-2-yl)-2-methoxy-2-oxidanylidene-1-phenyl-ethanesulfinate

Systemtic Name: 1-(2-butoxy-1-sulfinatooxy-pyrrolidin-2-yl)-2-methoxy-2-oxidanylidene-1-phenyl-ethanesulfinate Openeye Name: 1-(2-butoxy-1-sulfinatooxy-pyrrolidin-2-yl)-2-methoxy-2-oxo-1-phenyl-ethanesulfinate CAS Name: 1-(2-butoxy-1-sulfinatooxy-2-pyrrolidinyl)-2-methoxy-2-oxo-1-phenylethanesulfinate IUPAC Name: 1-(2-butoxy-1-sulfinatooxypyrrolidin-2-yl)-2-methoxy-2-oxo-1-phenylethanesulfinate Traditional Name: 1-(2-butoxy-1-sulfito-pyrrolidin-2-yl)-2-keto-2-methoxy-1-phenyl-ethanesulfinate Formula: C17H23NO8S2-2 MolecularWeight: 433.49642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1(CCCN1OS(=O)[O-])C(C2=CC=CC=C2)(C(=O)OC)S(=O)[O-]

Isomeric SMILES

CCCCOC1(CCCN1OS(=O)[O-])C(C2=CC=CC=C2)(C(=O)OC)S(=O)[O-]

InChI

InChI=1S/C17H25NO8S2/c1-3-4-13-25-16(11-8-12-18(16)26-28(22)23)17(27(20)21,15(19)24-2)14-9-6-5-7-10-14/h5-7,9-10H,3-4,8,11-13H2,1-2H3,(H,20,21)(H,22,23)/p-2