methyl (2S)-2-[[4-methoxy-3-[(2S)-2-methylpiperidin-1-yl]sulfonyl-phenyl]carbonylamino]-3-oxidanyl-propanoate

Systemtic Name: methyl (2S)-2-[[4-methoxy-3-[(2S)-2-methylpiperidin-1-yl]sulfonyl-phenyl]carbonylamino]-3-oxidanyl-propanoate Openeye Name: methyl (2S)-3-hydroxy-2-[[4-methoxy-3-[[(2S)-2-methyl-1-piperidyl]sulfonyl]benzoyl]amino]propanoate CAS Name: (2S)-3-hydroxy-2-[[[4-methoxy-3-[[(2S)-2-methyl-1-piperidinyl]sulfonyl]phenyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-hydroxy-2-[[4-methoxy-3-[(2S)-2-methylpiperidin-1-yl]sulfonylbenzoyl]amino]propanoate Traditional Name: (2S)-3-hydroxy-2-[[4-methoxy-3-[(2S)-2-methylpiperidino]sulfonyl-benzoyl]amino]propionic acid methyl ester Formula: C18H26N2O7S MolecularWeight: 414.47324

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC(CO)C(=O)OC)OC

Isomeric SMILES

C[C@H]1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)N[C@@H](CO)C(=O)OC)OC

InChI

InChI=1S/C18H26N2O7S/c1-12-6-4-5-9-20(12)28(24,25)16-10-13(7-8-15(16)26-2)17(22)19-14(11-21)18(23)27-3/h7-8,10,12,14,21H,4-6,9,11H2,1-3H3,(H,19,22)/t12-,14-/m0/s1