(6E)-4-azanyl-7-methyl-5-oxidanylidene-6-[[8-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]hydrazinylidene]naphthalene-2-sulfonic acid

Systemtic Name: (6E)-4-azanyl-7-methyl-5-oxidanylidene-6-[[8-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]hydrazinylidene]naphthalene-2-sulfonic acid Openeye Name: (6E)-4-amino-7-methyl-5-oxo-6-[[8-(2-sulfooxyethylsulfonyl)-2-naphthyl]hydrazono]naphthalene-2-sulfonic acid CAS Name: (6E)-4-amino-7-methyl-5-oxo-6-[[8-(2-sulfooxyethylsulfonyl)-2-naphthalenyl]hydrazinylidene]-2-naphthalenesulfonic acid IUPAC Name: (6E)-4-amino-7-methyl-5-oxo-6-[[8-(2-sulfooxyethylsulfonyl)naphthalen-2-yl]hydrazinylidene]naphthalene-2-sulfonic acid Traditional Name: (6E)-4-amino-5-keto-7-methyl-6-[[8-(2-sulfoxyethylsulfonyl)-2-naphthyl]hydrazono]naphthalene-2-sulfonic acid Formula: C23H21N3O10S3 MolecularWeight: 595.62194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC(=CC(=C2C(=O)C1=NNC3=CC4=C(C=CC=C4S(=O)(=O)CCOS(=O)(=O)O)C=C3)N)S(=O)(=O)O

Isomeric SMILES

CC\1=CC2=CC(=CC(=C2C(=O)/C1=N/NC3=CC4=C(C=CC=C4S(=O)(=O)CCOS(=O)(=O)O)C=C3)N)S(=O)(=O)O

InChI

InChI=1S/C23H21N3O10S3/c1-13-9-15-10-17(38(30,31)32)12-19(24)21(15)23(27)22(13)26-25-16-6-5-14-3-2-4-20(18(14)11-16)37(28,29)8-7-36-39(33,34)35/h2-6,9-12,25H,7-8,24H2,1H3,(H,30,31,32)(H,33,34,35)/b26-22+