3-oxidanyl-2-[[3-oxidanyl-5-oxidanylidene-5-[4-(phenylmethyl)piperidin-1-yl]pentanoyl]amino]propanoic acid

Systemtic Name: 3-oxidanyl-2-[[3-oxidanyl-5-oxidanylidene-5-[4-(phenylmethyl)piperidin-1-yl]pentanoyl]amino]propanoic acid Openeye Name: 2-[[5-(4-benzyl-1-piperidyl)-3-hydroxy-5-oxo-pentanoyl]amino]-3-hydroxy-propanoic acid CAS Name: 3-hydroxy-2-[[3-hydroxy-1,5-dioxo-5-[4-(phenylmethyl)-1-piperidinyl]pentyl]amino]propanoic acid IUPAC Name: 2-[[5-(4-benzylpiperidin-1-yl)-3-hydroxy-5-oxopentanoyl]amino]-3-hydroxypropanoic acid Traditional Name: 2-[[5-(4-benzylpiperidino)-3-hydroxy-5-keto-pentanoyl]amino]-3-hydroxy-propionic acid Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)CC(CC(=O)NC(CO)C(=O)O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)CC(CC(=O)NC(CO)C(=O)O)O

InChI

InChI=1S/C20H28N2O6/c23-13-17(20(27)28)21-18(25)11-16(24)12-19(26)22-8-6-15(7-9-22)10-14-4-2-1-3-5-14/h1-5,15-17,23-24H,6-13H2,(H,21,25)(H,27,28)