2-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]-3-methyl-pentanoic acid

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)sulfonylamino]-3-methyl-pentanoic acid Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)sulfonylamino]-3-methyl-pentanoic acid CAS Name: 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-3-methylpentanoic acid IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)sulfonylamino]-3-methylpentanoic acid Traditional Name: 2-[(5-bromo-2-methoxy-phenyl)sulfonylamino]-3-methyl-valeric acid Formula: C13H18BrNO5S MolecularWeight: 380.25472

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18BrNO5S/c1-4-8(2)12(13(16)17)15-21(18,19)11-7-9(14)5-6-10(11)20-3/h5-8,12,15H,4H2,1-3H3,(H,16,17)