6-(methylamino)-5-[[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2-sulfonic acid

Systemtic Name: 6-(methylamino)-5-[[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2-sulfonic acid Openeye Name: 6-(methylamino)-5-[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]azo-naphthalene-2-sulfonic acid CAS Name: 6-(methylamino)-5-[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]azo-2-naphthalenesulfonic acid IUPAC Name: 6-(methylamino)-5-[[2-sulfo-4-(2-sulfooxyethylsulfonyl)phenyl]diazenyl]naphthalene-2-sulfonic acid Traditional Name: 6-(methylamino)-5-[2-sulfo-4-(2-sulfoxyethylsulfonyl)phenyl]azo-naphthalene-2-sulfonic acid Formula: C19H19N3O12S4 MolecularWeight: 609.62706

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C2=C(C=C1)C=C(C=C2)S(=O)(=O)O)N=NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CNC1=C(C2=C(C=C1)C=C(C=C2)S(=O)(=O)O)N=NC3=C(C=C(C=C3)S(=O)(=O)CCOS(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C19H19N3O12S4/c1-20-17-6-2-12-10-14(36(25,26)27)3-5-15(12)19(17)22-21-16-7-4-13(11-18(16)37(28,29)30)35(23,24)9-8-34-38(31,32)33/h2-7,10-11,20H,8-9H2,1H3,(H,25,26,27)(H,28,29,30)(H,31,32,33)