2-azanyl-3-[4-[[2-oxidanylidene-3-(3-piperidin-4-ylpropyl)-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoic acid

Systemtic Name: 2-azanyl-3-[4-[[2-oxidanylidene-3-(3-piperidin-4-ylpropyl)-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoic acid Openeye Name: 2-amino-3-[4-[[2-oxo-3-[3-(4-piperidyl)propyl]oxazolidin-5-yl]methoxy]phenyl]propanoic acid CAS Name: 2-amino-3-[4-[[2-oxo-3-[3-(4-piperidinyl)propyl]-5-oxazolidinyl]methoxy]phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-[[2-oxo-3-(3-piperidin-4-ylpropyl)-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoic acid Traditional Name: 2-amino-3-[4-[[2-keto-3-[3-(4-piperidyl)propyl]oxazolidin-5-yl]methoxy]phenyl]propionic acid Formula: C21H31N3O5 MolecularWeight: 405.48794

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCCN2CC(OC2=O)COC3=CC=C(C=C3)CC(C(=O)O)N

Isomeric SMILES

C1CNCCC1CCCN2CC(OC2=O)COC3=CC=C(C=C3)CC(C(=O)O)N

InChI

InChI=1S/C21H31N3O5/c22-19(20(25)26)12-16-3-5-17(6-4-16)28-14-18-13-24(21(27)29-18)11-1-2-15-7-9-23-10-8-15/h3-6,15,18-19,23H,1-2,7-14,22H2,(H,25,26)