6-azanylidene-4-oxidanylidene-5-[2-[4-(propanoylamino)-2-sulfo-phenyl]hydrazinyl]naphthalene-2-sulfonic acid

Systemtic Name: 6-azanylidene-4-oxidanylidene-5-[2-[4-(propanoylamino)-2-sulfo-phenyl]hydrazinyl]naphthalene-2-sulfonic acid Openeye Name: 6-imino-4-oxo-5-[2-[4-(propanoylamino)-2-sulfo-phenyl]hydrazino]naphthalene-2-sulfonic acid CAS Name: 6-imino-4-oxo-5-[[4-(1-oxopropylamino)-2-sulfophenyl]hydrazo]-2-naphthalenesulfonic acid IUPAC Name: 6-imino-4-oxo-5-[2-[4-(propanoylamino)-2-sulfophenyl]hydrazinyl]naphthalene-2-sulfonic acid Traditional Name: 6-imino-4-keto-5-[N'-(4-propionamido-2-sulfo-phenyl)hydrazino]naphthalene-2-sulfonic acid Formula: C19H18N4O8S2 MolecularWeight: 494.49822

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)O)C=CC2=N)S(=O)(=O)O

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)O)C=CC2=N)S(=O)(=O)O

InChI

InChI=1S/C19H18N4O8S2/c1-2-17(25)21-11-4-6-14(16(8-11)33(29,30)31)22-23-19-13(20)5-3-10-7-12(32(26,27)28)9-15(24)18(10)19/h3-9,20,22-23H,2H2,1H3,(H,21,25)(H,26,27,28)(H,29,30,31)