methyl (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2S)-3-(tert-butoxycarbonylamino)-2-[(4-chlorophenyl)sulfonylamino]propanoate CAS Name: (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(4-chlorophenyl)sulfonylamino]-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-3-(tert-butoxycarbonylamino)-2-[(4-chlorophenyl)sulfonylamino]propionic acid methyl ester Formula: C15H21ClN2O6S MolecularWeight: 392.85504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NC[C@@H](C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H21ClN2O6S/c1-15(2,3)24-14(20)17-9-12(13(19)23-4)18-25(21,22)11-7-5-10(16)6-8-11/h5-8,12,18H,9H2,1-4H3,(H,17,20)/t12-/m0/s1