8-[(2E)-2-(1-cyano-2-oxidanylidene-propylidene)hydrazinyl]quinoline-5-sulfonic acid

Systemtic Name: 8-[(2E)-2-(1-cyano-2-oxidanylidene-propylidene)hydrazinyl]quinoline-5-sulfonic acid Openeye Name: 8-[(2E)-2-(1-cyano-2-oxo-propylidene)hydrazino]quinoline-5-sulfonic acid CAS Name: 8-[(2E)-2-(1-cyano-2-oxopropylidene)hydrazinyl]-5-quinolinesulfonic acid IUPAC Name: 8-[(2E)-2-(1-cyano-2-oxopropylidene)hydrazinyl]quinoline-5-sulfonic acid Traditional Name: 8-[(N'E)-N'-(1-cyano-2-keto-propylidene)hydrazino]quinoline-5-sulfonic acid Formula: C13H10N4O4S MolecularWeight: 318.3079

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=NNC1=C2C(=C(C=C1)S(=O)(=O)O)C=CC=N2)C#N

Isomeric SMILES

CC(=O)/C(=N/NC1=C2C(=C(C=C1)S(=O)(=O)O)C=CC=N2)/C#N

InChI

InChI=1S/C13H10N4O4S/c1-8(18)11(7-14)17-16-10-4-5-12(22(19,20)21)9-3-2-6-15-13(9)10/h2-6,16H,1H3,(H,19,20,21)/b17-11+