[(2S)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] 3-(phenylsulfonylamino)propanoate

Systemtic Name: [(2S)-1-oxidanylidene-1-[(4-piperidin-1-ylsulfonylphenyl)amino]propan-2-yl] 3-(phenylsulfonylamino)propanoate Openeye Name: [(1S)-1-methyl-2-oxo-2-[4-(1-piperidylsulfonyl)anilino]ethyl] 3-(benzenesulfonamido)propanoate CAS Name: 3-(benzenesulfonamido)propanoic acid [(2S)-1-oxo-1-[4-(1-piperidinylsulfonyl)anilino]propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(4-piperidin-1-ylsulfonylanilino)propan-2-yl] 3-(benzenesulfonamido)propanoate Traditional Name: 3-(benzenesulfonamido)propionic acid [(1S)-2-keto-1-methyl-2-(4-piperidinosulfonylanilino)ethyl] ester Formula: C23H29N3O7S2 MolecularWeight: 523.62226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)OC(=O)CCNS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2)OC(=O)CCNS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H29N3O7S2/c1-18(33-22(27)14-15-24-34(29,30)20-8-4-2-5-9-20)23(28)25-19-10-12-21(13-11-19)35(31,32)26-16-6-3-7-17-26/h2,4-5,8-13,18,24H,3,6-7,14-17H2,1H3,(H,25,28)/t18-/m0/s1