2-[(3-methoxycarbonylphenyl)methylsulfonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[(3-methoxycarbonylphenyl)methylsulfonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(3-methoxycarbonylphenyl)methylsulfonylamino]-3-methyl-butanoic acid CAS Name: 2-[(3-methoxycarbonylphenyl)methylsulfonylamino]-3-methylbutanoic acid IUPAC Name: 2-[(3-methoxycarbonylphenyl)methylsulfonylamino]-3-methylbutanoic acid Traditional Name: 2-[(3-carbomethoxybenzyl)sulfonylamino]-3-methyl-butyric acid Formula: C14H19NO6S MolecularWeight: 329.36876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NS(=O)(=O)CC1=CC=CC(=C1)C(=O)OC

Isomeric SMILES

CC(C)C(C(=O)O)NS(=O)(=O)CC1=CC=CC(=C1)C(=O)OC

InChI

InChI=1S/C14H19NO6S/c1-9(2)12(13(16)17)15-22(19,20)8-10-5-4-6-11(7-10)14(18)21-3/h4-7,9,12,15H,8H2,1-3H3,(H,16,17)