1-[4-methyl-4-[(5-nitropyridin-2-yl)disulfanyl]pentanoyl]oxy-2,5-bis(oxidanylidene)pyrrolidine-3-sulfonic acid

Systemtic Name: 1-[4-methyl-4-[(5-nitropyridin-2-yl)disulfanyl]pentanoyl]oxy-2,5-bis(oxidanylidene)pyrrolidine-3-sulfonic acid Openeye Name: 1-[4-methyl-4-[(5-nitro-2-pyridyl)disulfanyl]pentanoyl]oxy-2,5-dioxo-pyrrolidine-3-sulfonic acid CAS Name: 1-[4-methyl-4-[(5-nitro-2-pyridinyl)disulfanyl]-1-oxopentoxy]-2,5-dioxo-3-pyrrolidinesulfonic acid IUPAC Name: 1-[4-methyl-4-[(5-nitropyridin-2-yl)disulfanyl]pentanoyl]oxy-2,5-dioxopyrrolidine-3-sulfonic acid Traditional Name: 2,5-diketo-1-[4-methyl-4-[(5-nitro-2-pyridyl)disulfanyl]pentanoyl]oxy-pyrrolidine-3-sulfonic acid Formula: C15H17N3O9S3 MolecularWeight: 479.50518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(=O)ON1C(=O)CC(C1=O)S(=O)(=O)O)SSC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CCC(=O)ON1C(=O)CC(C1=O)S(=O)(=O)O)SSC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H17N3O9S3/c1-15(2,29-28-11-4-3-9(8-16-11)18(22)23)6-5-13(20)27-17-12(19)7-10(14(17)21)30(24,25)26/h3-4,8,10H,5-7H2,1-2H3,(H,24,25,26)