(2S)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: (2S)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: (2S)-2-(benzyloxycarbonylamino)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: (2S)-5-[4-(2-hydroxyethyl)-1-piperazinyl]-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: (2S)-5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: (2S)-2-(benzyloxycarbonylamino)-5-[4-(2-hydroxyethyl)piperazino]-5-keto-valeric acid Formula: C19H27N3O6 MolecularWeight: 393.43418

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCO)C(=O)CCC(C(=O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

C1CN(CCN1CCO)C(=O)CC[C@@H](C(=O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H27N3O6/c23-13-12-21-8-10-22(11-9-21)17(24)7-6-16(18(25)26)20-19(27)28-14-15-4-2-1-3-5-15/h1-5,16,23H,6-14H2,(H,20,27)(H,25,26)/t16-/m0/s1