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

Systemtic Name: 2-azanyl-3-[4-[[2-oxidanylidene-3-(1-piperidin-4-ylbutyl)-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoic acid Openeye Name: 2-amino-3-[4-[[2-oxo-3-[1-(4-piperidyl)butyl]oxazolidin-5-yl]methoxy]phenyl]propanoic acid CAS Name: 2-amino-3-[4-[[2-oxo-3-[1-(4-piperidinyl)butyl]-5-oxazolidinyl]methoxy]phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-[[2-oxo-3-(1-piperidin-4-ylbutyl)-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoic acid Traditional Name: 2-amino-3-[4-[[2-keto-3-[1-(4-piperidyl)butyl]oxazolidin-5-yl]methoxy]phenyl]propionic acid Formula: C22H33N3O5 MolecularWeight: 419.51452

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1CCNCC1)N2CC(OC2=O)COC3=CC=C(C=C3)CC(C(=O)O)N

Isomeric SMILES

CCCC(C1CCNCC1)N2CC(OC2=O)COC3=CC=C(C=C3)CC(C(=O)O)N

InChI

InChI=1S/C22H33N3O5/c1-2-3-20(16-8-10-24-11-9-16)25-13-18(30-22(25)28)14-29-17-6-4-15(5-7-17)12-19(23)21(26)27/h4-7,16,18-20,24H,2-3,8-14,23H2,1H3,(H,26,27)