(phenylmethyl) (2S)-5-chloranylsulfonyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Systemtic Name: (phenylmethyl) (2S)-5-chloranylsulfonyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Openeye Name: benzyl (2S)-2-(tert-butoxycarbonylamino)-5-chlorosulfonyl-pentanoate CAS Name: (2S)-5-chlorosulfonyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]pentanoic acid (phenylmethyl) ester IUPAC Name: benzyl (2S)-5-chlorosulfonyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-5-chlorosulfonyl-valeric acid benzyl ester Formula: C17H24ClNO6S MolecularWeight: 405.89356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CCCS(=O)(=O)Cl)C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CCCS(=O)(=O)Cl)C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H24ClNO6S/c1-17(2,3)25-16(21)19-14(10-7-11-26(18,22)23)15(20)24-12-13-8-5-4-6-9-13/h4-6,8-9,14H,7,10-12H2,1-3H3,(H,19,21)/t14-/m0/s1