methyl 2-[(4-aminophenyl)methylsulfonylamino]-3-methyl-butanoate

Systemtic Name: methyl 2-[(4-aminophenyl)methylsulfonylamino]-3-methyl-butanoate Openeye Name: methyl 2-[(4-aminophenyl)methylsulfonylamino]-3-methyl-butanoate CAS Name: 2-[(4-aminophenyl)methylsulfonylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl 2-[(4-aminophenyl)methylsulfonylamino]-3-methylbutanoate Traditional Name: 2-[(4-aminobenzyl)sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O4S/c1-9(2)12(13(16)19-3)15-20(17,18)8-10-4-6-11(14)7-5-10/h4-7,9,12,15H,8,14H2,1-3H3