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

Systemtic Name: (2S)-2-benzamido-5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxidanylidene-pentanoic acid Openeye Name: (2S)-2-benzamido-5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxo-pentanoic acid CAS Name: (2S)-2-benzamido-5-[4-(2-hydroxyethyl)-1-piperazinyl]-5-oxopentanoic acid IUPAC Name: (2S)-2-benzamido-5-[4-(2-hydroxyethyl)piperazin-1-yl]-5-oxopentanoic acid Traditional Name: (2S)-2-benzamido-5-[4-(2-hydroxyethyl)piperazino]-5-keto-valeric acid Formula: C18H25N3O5 MolecularWeight: 363.4082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H25N3O5/c22-13-12-20-8-10-21(11-9-20)16(23)7-6-15(18(25)26)19-17(24)14-4-2-1-3-5-14/h1-5,15,22H,6-13H2,(H,19,24)(H,25,26)/t15-/m0/s1