[4-[[3,5-bis(bromanyl)pyridin-2-yl]diazenyl]-2-propyl-phenyl]-ethyl-sulfamic acid

Systemtic Name: [4-[[3,5-bis(bromanyl)pyridin-2-yl]diazenyl]-2-propyl-phenyl]-ethyl-sulfamic acid Openeye Name: [4-[(3,5-dibromo-2-pyridyl)azo]-2-propyl-phenyl]-ethyl-sulfamic acid CAS Name: [4-[(3,5-dibromo-2-pyridinyl)azo]-2-propylphenyl]-ethylsulfamic acid IUPAC Name: [4-[(3,5-dibromopyridin-2-yl)diazenyl]-2-propylphenyl]-ethylsulfamic acid Traditional Name: [4-[(3,5-dibromo-2-pyridyl)azo]-2-propyl-phenyl]-ethyl-sulfamic acid Formula: C16H18Br2N4O3S MolecularWeight: 506.21212

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)N=NC2=C(C=C(C=N2)Br)Br)N(CC)S(=O)(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)N=NC2=C(C=C(C=N2)Br)Br)N(CC)S(=O)(=O)O

InChI

InChI=1S/C16H18Br2N4O3S/c1-3-5-11-8-13(6-7-15(11)22(4-2)26(23,24)25)20-21-16-14(18)9-12(17)10-19-16/h6-10H,3-5H2,1-2H3,(H,23,24,25)