2-methylpropyl 6-azanyl-2-[(4-methylphenyl)sulfonylamino]hexanoate

Systemtic Name: 2-methylpropyl 6-azanyl-2-[(4-methylphenyl)sulfonylamino]hexanoate Openeye Name: isobutyl 6-amino-2-(p-tolylsulfonylamino)hexanoate CAS Name: 6-amino-2-[(4-methylphenyl)sulfonylamino]hexanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 6-amino-2-[(4-methylphenyl)sulfonylamino]hexanoate Traditional Name: 6-amino-2-(tosylamino)hexanoic acid isobutyl ester Formula: C17H28N2O4S MolecularWeight: 356.48022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCN)C(=O)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCCN)C(=O)OCC(C)C

InChI

InChI=1S/C17H28N2O4S/c1-13(2)12-23-17(20)16(6-4-5-11-18)19-24(21,22)15-9-7-14(3)8-10-15/h7-10,13,16,19H,4-6,11-12,18H2,1-3H3