6-ethanoylimino-4-oxidanylidene-2-[2-[3-(2-sulfooxyethylsulfonyl)phenyl]hydrazinyl]naphthalene-1-sulfonic acid

Systemtic Name: 6-ethanoylimino-4-oxidanylidene-2-[2-[3-(2-sulfooxyethylsulfonyl)phenyl]hydrazinyl]naphthalene-1-sulfonic acid Openeye Name: 6-acetylimino-4-oxo-2-[2-[3-(2-sulfooxyethylsulfonyl)phenyl]hydrazino]naphthalene-1-sulfonic acid CAS Name: 6-acetylimino-4-oxo-2-[[3-(2-sulfooxyethylsulfonyl)phenyl]hydrazo]-1-naphthalenesulfonic acid IUPAC Name: 6-acetylimino-4-oxo-2-[2-[3-(2-sulfooxyethylsulfonyl)phenyl]hydrazinyl]naphthalene-1-sulfonic acid Traditional Name: 6-acetylimino-4-keto-2-[N'-[3-(2-sulfoxyethylsulfonyl)phenyl]hydrazino]naphthalene-1-sulfonic acid Formula: C20H19N3O11S3 MolecularWeight: 573.57336

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N=C1C=CC2=C(C(=CC(=O)C2=C1)NNC3=CC(=CC=C3)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CC(=O)N=C1C=CC2=C(C(=CC(=O)C2=C1)NNC3=CC(=CC=C3)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C20H19N3O11S3/c1-12(24)21-13-5-6-16-17(10-13)19(25)11-18(20(16)36(28,29)30)23-22-14-3-2-4-15(9-14)35(26,27)8-7-34-37(31,32)33/h2-6,9-11,22-23H,7-8H2,1H3,(H,28,29,30)(H,31,32,33)