6-azanylidene-5-[2-[2,5-bis(ethoxycarbonyl)phenyl]hydrazinyl]-4-oxidanylidene-naphthalene-2-sulfonic acid

Systemtic Name: 6-azanylidene-5-[2-[2,5-bis(ethoxycarbonyl)phenyl]hydrazinyl]-4-oxidanylidene-naphthalene-2-sulfonic acid Openeye Name: 5-[2-[2,5-bis(ethoxycarbonyl)phenyl]hydrazino]-6-imino-4-oxo-naphthalene-2-sulfonic acid CAS Name: 5-[[2,5-bis(ethoxycarbonyl)phenyl]hydrazo]-6-imino-4-oxo-2-naphthalenesulfonic acid IUPAC Name: 5-[2-[2,5-bis(ethoxycarbonyl)phenyl]hydrazinyl]-6-imino-4-oxonaphthalene-2-sulfonic acid Traditional Name: 5-[N'-(2,5-dicarbethoxyphenyl)hydrazino]-6-imino-4-keto-naphthalene-2-sulfonic acid Formula: C22H21N3O8S MolecularWeight: 487.48244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)O)C=CC2=N

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)C(=O)OCC)NNC2=C3C(=CC(=CC3=O)S(=O)(=O)O)C=CC2=N

InChI

InChI=1S/C22H21N3O8S/c1-3-32-21(27)13-5-7-15(22(28)33-4-2)17(10-13)24-25-20-16(23)8-6-12-9-14(34(29,30)31)11-18(26)19(12)20/h5-11,23-25H,3-4H2,1-2H3,(H,29,30,31)