3-acetamido-3-[(E)-dimethylaminodiazenyl]cyclohexa-1,4-diene-1-sulfonic acid

Systemtic Name: 3-acetamido-3-[(E)-dimethylaminodiazenyl]cyclohexa-1,4-diene-1-sulfonic acid Openeye Name: 3-acetamido-3-[(E)-dimethylaminoazo]cyclohexa-1,4-diene-1-sulfonic acid CAS Name: 3-acetamido-3-[(E)-dimethylaminoazo]-1-cyclohexa-1,4-dienesulfonic acid IUPAC Name: 3-acetamido-3-[(E)-dimethylaminodiazenyl]cyclohexa-1,4-diene-1-sulfonic acid Traditional Name: 3-acetamido-3-[(E)-dimethylaminoazo]cyclohexa-1,4-diene-1-sulfonic acid Formula: C10H16N4O4S MolecularWeight: 288.32344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(C=CCC(=C1)S(=O)(=O)O)N=NN(C)C

Isomeric SMILES

CC(=O)NC1(C=CCC(=C1)S(=O)(=O)O)/N=N/N(C)C

InChI

InChI=1S/C10H16N4O4S/c1-8(15)11-10(12-13-14(2)3)6-4-5-9(7-10)19(16,17)18/h4,6-7H,5H2,1-3H3,(H,11,15)(H,16,17,18)/b13-12+