(4-methylphenyl)sulfonyl 6-azanyl-2-(2-chloranylethanoylamino)hexanoate

Systemtic Name: (4-methylphenyl)sulfonyl 6-azanyl-2-(2-chloranylethanoylamino)hexanoate Openeye Name: p-tolylsulfonyl 6-amino-2-[(2-chloroacetyl)amino]hexanoate CAS Name: 6-amino-2-[(2-chloro-1-oxoethyl)amino]hexanoic acid (4-methylphenyl)sulfonyl ester IUPAC Name: (4-methylphenyl)sulfonyl 6-amino-2-[(2-chloroacetyl)amino]hexanoate Traditional Name: 6-amino-2-[(2-chloroacetyl)amino]hexanoic acid tosyl ester Formula: C15H21ClN2O5S MolecularWeight: 376.85564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(=O)C(CCCCN)NC(=O)CCl

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(=O)C(CCCCN)NC(=O)CCl

InChI

InChI=1S/C15H21ClN2O5S/c1-11-5-7-12(8-6-11)24(21,22)23-15(20)13(4-2-3-9-17)18-14(19)10-16/h5-8,13H,2-4,9-10,17H2,1H3,(H,18,19)