4-azanylidene-2-(4-azanylidene-1-oxidanylidene-2-sulfo-butan-2-yl)sulfanyl-1-oxidanylidene-butane-2-sulfonic acid

Systemtic Name: 4-azanylidene-2-(4-azanylidene-1-oxidanylidene-2-sulfo-butan-2-yl)sulfanyl-1-oxidanylidene-butane-2-sulfonic acid Openeye Name: 2-(1-formyl-3-imino-1-sulfo-propyl)sulfanyl-4-imino-1-oxo-butane-2-sulfonic acid CAS Name: 4-imino-2-[(4-imino-1-oxo-2-sulfobutan-2-yl)thio]-1-oxo-2-butanesulfonic acid IUPAC Name: 4-imino-2-(4-imino-1-oxo-2-sulfobutan-2-yl)sulfanyl-1-oxobutane-2-sulfonic acid Traditional Name: 2-[(1-formyl-3-imino-1-sulfo-propyl)thio]-4-imino-1-keto-butane-2-sulfonic acid Formula: C8H12N2O8S3 MolecularWeight: 360.38448

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Descriptors Computed from Structure

Canonical SMILES:

C(C=N)C(C=O)(SC(CC=N)(C=O)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

C(C=N)C(C=O)(SC(CC=N)(C=O)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C8H12N2O8S3/c9-3-1-7(5-11,20(13,14)15)19-8(6-12,2-4-10)21(16,17)18/h3-6,9-10H,1-2H2,(H,13,14,15)(H,16,17,18)