4-oxidanyl-4-[(4-phenylazanyl-5-sulfo-naphthalen-1-yl)diazenyl]-1H-naphthalene-2,7-disulfonic acid

Systemtic Name: 4-oxidanyl-4-[(4-phenylazanyl-5-sulfo-naphthalen-1-yl)diazenyl]-1H-naphthalene-2,7-disulfonic acid Openeye Name: 4-[(4-anilino-5-sulfo-1-naphthyl)azo]-4-hydroxy-1H-naphthalene-2,7-disulfonic acid CAS Name: 4-[(4-anilino-5-sulfo-1-naphthalenyl)azo]-4-hydroxy-1H-naphthalene-2,7-disulfonic acid IUPAC Name: 4-[(4-anilino-5-sulfonaphthalen-1-yl)diazenyl]-4-hydroxy-1H-naphthalene-2,7-disulfonic acid Traditional Name: 4-[(4-anilino-5-sulfo-1-naphthyl)azo]-4-hydroxy-1H-naphthalene-2,7-disulfonic acid Formula: C26H21N3O10S3 MolecularWeight: 631.65404

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C=CC(=C2)S(=O)(=O)O)C(C=C1S(=O)(=O)O)(N=NC3=C4C=CC=C(C4=C(C=C3)NC5=CC=CC=C5)S(=O)(=O)O)O

Isomeric SMILES

C1C2=C(C=CC(=C2)S(=O)(=O)O)C(C=C1S(=O)(=O)O)(N=NC3=C4C=CC=C(C4=C(C=C3)NC5=CC=CC=C5)S(=O)(=O)O)O

InChI

InChI=1S/C26H21N3O10S3/c30-26(15-19(41(34,35)36)14-16-13-18(40(31,32)33)9-10-21(16)26)29-28-22-11-12-23(27-17-5-2-1-3-6-17)25-20(22)7-4-8-24(25)42(37,38)39/h1-13,15,27,30H,14H2,(H,31,32,33)(H,34,35,36)(H,37,38,39)