2-[(3-bromanyl-4-methoxy-phenyl)sulfonylamino]-4-methyl-pentanoic acid

Systemtic Name: 2-[(3-bromanyl-4-methoxy-phenyl)sulfonylamino]-4-methyl-pentanoic acid Openeye Name: 2-[(3-bromo-4-methoxy-phenyl)sulfonylamino]-4-methyl-pentanoic acid CAS Name: 2-[(3-bromo-4-methoxyphenyl)sulfonylamino]-4-methylpentanoic acid IUPAC Name: 2-[(3-bromo-4-methoxyphenyl)sulfonylamino]-4-methylpentanoic acid Traditional Name: 2-[(3-bromo-4-methoxy-phenyl)sulfonylamino]-4-methyl-valeric acid Formula: C13H18BrNO5S MolecularWeight: 380.25472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC(=C(C=C1)OC)Br

Isomeric SMILES

CC(C)CC(C(=O)O)NS(=O)(=O)C1=CC(=C(C=C1)OC)Br

InChI

InChI=1S/C13H18BrNO5S/c1-8(2)6-11(13(16)17)15-21(18,19)9-4-5-12(20-3)10(14)7-9/h4-5,7-8,11,15H,6H2,1-3H3,(H,16,17)