sodium 1-[8-[2,5-bis(oxidanylidene)pyrrol-1-yl]undecanoyloxy]-2,5-bis(oxidanylidene)pyrrolidine-3-sulfonate

Systemtic Name: sodium 1-[8-[2,5-bis(oxidanylidene)pyrrol-1-yl]undecanoyloxy]-2,5-bis(oxidanylidene)pyrrolidine-3-sulfonate Openeye Name: sodium 1-[8-(2,5-dioxopyrrol-1-yl)undecanoyloxy]-2,5-dioxo-pyrrolidine-3-sulfonate CAS Name: sodium 1-[8-(2,5-dioxo-1-pyrrolyl)-1-oxoundecoxy]-2,5-dioxo-3-pyrrolidinesulfonate IUPAC Name: sodium 1-[8-(2,5-dioxopyrrol-1-yl)undecanoyloxy]-2,5-dioxopyrrolidine-3-sulfonate Traditional Name: sodium 2,5-diketo-1-(8-maleimidoundecanoyloxy)pyrrolidine-3-sulfonate Formula: C19H25N2NaO9S MolecularWeight: 480.46457

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCCCCC(=O)ON1C(=O)CC(C1=O)S(=O)(=O)[O-])N2C(=O)C=CC2=O.[Na+]

Isomeric SMILES

CCCC(CCCCCCC(=O)ON1C(=O)CC(C1=O)S(=O)(=O)[O-])N2C(=O)C=CC2=O.[Na+]

InChI

InChI=1S/C19H26N2O9S.Na/c1-2-7-13(20-15(22)10-11-16(20)23)8-5-3-4-6-9-18(25)30-21-17(24)12-14(19(21)26)31(27,28)29;/h10-11,13-14H,2-9,12H2,1H3,(H,27,28,29);/q;+1/p-1