tert-butyl 2-[[(4-methylphenyl)sulfonylamino]methyl]pentanoate

Systemtic Name: tert-butyl 2-[[(4-methylphenyl)sulfonylamino]methyl]pentanoate Openeye Name: tert-butyl 2-[(p-tolylsulfonylamino)methyl]pentanoate CAS Name: 2-[[(4-methylphenyl)sulfonylamino]methyl]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[(4-methylphenyl)sulfonylamino]methyl]pentanoate Traditional Name: 2-[(tosylamino)methyl]valeric acid tert-butyl ester Formula: C17H27NO4S MolecularWeight: 341.46558

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CNS(=O)(=O)C1=CC=C(C=C1)C)C(=O)OC(C)(C)C

Isomeric SMILES

CCCC(CNS(=O)(=O)C1=CC=C(C=C1)C)C(=O)OC(C)(C)C

InChI

InChI=1S/C17H27NO4S/c1-6-7-14(16(19)22-17(3,4)5)12-18-23(20,21)15-10-8-13(2)9-11-15/h8-11,14,18H,6-7,12H2,1-5H3