2-[[1,4-dimethyl-2,6-bis(oxidanylidene)-3H-pyridin-5-yl]diazenyl]benzenesulfonic acid

Systemtic Name: 2-[[1,4-dimethyl-2,6-bis(oxidanylidene)-3H-pyridin-5-yl]diazenyl]benzenesulfonic acid Openeye Name: 2-[(1,4-dimethyl-2,6-dioxo-3H-pyridin-5-yl)azo]benzenesulfonic acid CAS Name: 2-[(1,4-dimethyl-2,6-dioxo-3H-pyridin-5-yl)azo]benzenesulfonic acid IUPAC Name: 2-[(1,4-dimethyl-2,6-dioxo-3H-pyridin-5-yl)diazenyl]benzenesulfonic acid Traditional Name: 2-[(2,6-diketo-1,4-dimethyl-3H-pyridin-5-yl)azo]besylic acid Formula: C13H13N3O5S MolecularWeight: 323.32442

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=O)C1)C)N=NC2=CC=CC=C2S(=O)(=O)O

Isomeric SMILES

CC1=C(C(=O)N(C(=O)C1)C)N=NC2=CC=CC=C2S(=O)(=O)O

InChI

InChI=1S/C13H13N3O5S/c1-8-7-11(17)16(2)13(18)12(8)15-14-9-5-3-4-6-10(9)22(19,20)21/h3-6H,7H2,1-2H3,(H,19,20,21)