1-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-[2,5-bis(oxidanylidene)pyrrol-1-yl]-sulfo-methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 1-[[2,5-bis(oxidanylidene)pyrrolidin-1-yl]-[2,5-bis(oxidanylidene)pyrrol-1-yl]-sulfo-methyl]cyclohexane-1-carboxylic acid Openeye Name: 1-[(2,5-dioxopyrrolidin-1-yl)-(2,5-dioxopyrrol-1-yl)-sulfo-methyl]cyclohexanecarboxylic acid CAS Name: 1-[(2,5-dioxo-1-pyrrolidinyl)-(2,5-dioxo-1-pyrrolyl)-sulfomethyl]-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(2,5-dioxopyrrolidin-1-yl)-(2,5-dioxopyrrol-1-yl)-sulfomethyl]cyclohexane-1-carboxylic acid Traditional Name: 1-(maleimido-succinimido-sulfo-methyl)cyclohexanecarboxylic acid Formula: C16H18N2O9S MolecularWeight: 414.38712

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)O)C(N2C(=O)CCC2=O)(N3C(=O)C=CC3=O)S(=O)(=O)O

Isomeric SMILES

C1CCC(CC1)(C(=O)O)C(N2C(=O)CCC2=O)(N3C(=O)C=CC3=O)S(=O)(=O)O

InChI

InChI=1S/C16H18N2O9S/c19-10-4-5-11(20)17(10)16(28(25,26)27,18-12(21)6-7-13(18)22)15(14(23)24)8-2-1-3-9-15/h4-5H,1-3,6-9H2,(H,23,24)(H,25,26,27)