methyl (2S)-3-phenyl-2-(piperazin-1-ylsulfonylamino)propanoate

Systemtic Name: methyl (2S)-3-phenyl-2-(piperazin-1-ylsulfonylamino)propanoate Openeye Name: methyl (2S)-3-phenyl-2-(piperazin-1-ylsulfonylamino)propanoate CAS Name: (2S)-3-phenyl-2-(1-piperazinylsulfonylamino)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-phenyl-2-(piperazin-1-ylsulfonylamino)propanoate Traditional Name: (2S)-3-phenyl-2-(piperazinosulfonylamino)propionic acid methyl ester Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NS(=O)(=O)N2CCNCC2

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NS(=O)(=O)N2CCNCC2

InChI

InChI=1S/C14H21N3O4S/c1-21-14(18)13(11-12-5-3-2-4-6-12)16-22(19,20)17-9-7-15-8-10-17/h2-6,13,15-16H,7-11H2,1H3/t13-/m0/s1