8-oxidanylidene-8-[(2E)-2-[(5-sulfofuran-2-yl)methylidene]hydrazinyl]octanoic acid

Systemtic Name: 8-oxidanylidene-8-[(2E)-2-[(5-sulfofuran-2-yl)methylidene]hydrazinyl]octanoic acid Openeye Name: 8-oxo-8-[(2E)-2-[(5-sulfo-2-furyl)methylene]hydrazino]octanoic acid CAS Name: 8-oxo-8-[(2E)-2-[(5-sulfo-2-furanyl)methylidene]hydrazinyl]octanoic acid IUPAC Name: 8-oxo-8-[(2E)-2-[(5-sulfofuran-2-yl)methylidene]hydrazinyl]octanoic acid Traditional Name: 8-keto-8-[(N'E)-N'-[(5-sulfo-2-furyl)methylene]hydrazino]caprylic acid Formula: C13H18N2O7S MolecularWeight: 346.35622

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(OC(=C1)S(=O)(=O)O)C=NNC(=O)CCCCCCC(=O)O

Isomeric SMILES

C1=C(OC(=C1)S(=O)(=O)O)/C=N/NC(=O)CCCCCCC(=O)O

InChI

InChI=1S/C13H18N2O7S/c16-11(5-3-1-2-4-6-12(17)18)15-14-9-10-7-8-13(22-10)23(19,20)21/h7-9H,1-6H2,(H,15,16)(H,17,18)(H,19,20,21)/b14-9+