(2S)-6-azanyl-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoic acid

Systemtic Name: (2S)-6-azanyl-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoic acid Openeye Name: (2S)-6-amino-2-[tert-butoxycarbonyl(p-tolylsulfonyl)amino]hexanoic acid CAS Name: (2S)-6-amino-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxy-oxomethyl]amino]hexanoic acid IUPAC Name: (2S)-6-amino-2-[(4-methylphenyl)sulfonyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]hexanoic acid Traditional Name: (2S)-6-amino-2-[tert-butoxycarbonyl(tosyl)amino]hexanoic acid Formula: C18H28N2O6S MolecularWeight: 400.48972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C(CCCCN)C(=O)O)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N([C@@H](CCCCN)C(=O)O)C(=O)OC(C)(C)C

InChI

InChI=1S/C18H28N2O6S/c1-13-8-10-14(11-9-13)27(24,25)20(17(23)26-18(2,3)4)15(16(21)22)7-5-6-12-19/h8-11,15H,5-7,12,19H2,1-4H3,(H,21,22)/t15-/m0/s1