6-[(3-bromanyl-4-methoxy-phenyl)sulfonylamino]hexanoic acid

Systemtic Name: 6-[(3-bromanyl-4-methoxy-phenyl)sulfonylamino]hexanoic acid Openeye Name: 6-[(3-bromo-4-methoxy-phenyl)sulfonylamino]hexanoic acid CAS Name: 6-[(3-bromo-4-methoxyphenyl)sulfonylamino]hexanoic acid IUPAC Name: 6-[(3-bromo-4-methoxyphenyl)sulfonylamino]hexanoic acid Traditional Name: 6-[(3-bromo-4-methoxy-phenyl)sulfonylamino]hexanoic acid Formula: C13H18BrNO5S MolecularWeight: 380.25472

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NCCCCCC(=O)O)Br

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NCCCCCC(=O)O)Br

InChI

InChI=1S/C13H18BrNO5S/c1-20-12-7-6-10(9-11(12)14)21(18,19)15-8-4-2-3-5-13(16)17/h6-7,9,15H,2-5,8H2,1H3,(H,16,17)