2-(azepan-2-ylsulfonylamino)-4-methyl-pentanoic acid

Systemtic Name: 2-(azepan-2-ylsulfonylamino)-4-methyl-pentanoic acid Openeye Name: 2-(azepan-2-ylsulfonylamino)-4-methyl-pentanoic acid CAS Name: 2-(2-azepanylsulfonylamino)-4-methylpentanoic acid IUPAC Name: 2-(azepan-2-ylsulfonylamino)-4-methylpentanoic acid Traditional Name: 2-(azepan-2-ylsulfonylamino)-4-methyl-valeric acid Formula: C24H48N4O8S2 MolecularWeight: 584.78992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NS(=O)(=O)C1CCCCCN1.CC(C)CC(C(=O)O)NS(=O)(=O)C1CCCCCN1

Isomeric SMILES

CC(C)CC(C(=O)O)NS(=O)(=O)C1CCCCCN1.CC(C)CC(C(=O)O)NS(=O)(=O)C1CCCCCN1

InChI

InChI=1S/2C12H24N2O4S/c2*1-9(2)8-10(12(15)16)14-19(17,18)11-6-4-3-5-7-13-11/h2*9-11,13-14H,3-8H2,1-2H3,(H,15,16)