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

Systemtic Name: 2-azanyl-3-[4-[[2-oxidanylidene-3-(1-piperazin-1-ylbutyl)-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoic acid Openeye Name: 2-amino-3-[4-[[2-oxo-3-(1-piperazin-1-ylbutyl)oxazolidin-5-yl]methoxy]phenyl]propanoic acid CAS Name: 2-amino-3-[4-[[2-oxo-3-[1-(1-piperazinyl)butyl]-5-oxazolidinyl]methoxy]phenyl]propanoic acid IUPAC Name: 2-amino-3-[4-[[2-oxo-3-(1-piperazin-1-ylbutyl)-1,3-oxazolidin-5-yl]methoxy]phenyl]propanoic acid Traditional Name: 2-amino-3-[4-[[2-keto-3-(1-piperazinobutyl)oxazolidin-5-yl]methoxy]phenyl]propionic acid Formula: C21H32N4O5 MolecularWeight: 420.50258

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(N1CCNCC1)N2CC(OC2=O)COC3=CC=C(C=C3)CC(C(=O)O)N

Isomeric SMILES

CCCC(N1CCNCC1)N2CC(OC2=O)COC3=CC=C(C=C3)CC(C(=O)O)N

InChI

InChI=1S/C21H32N4O5/c1-2-3-19(24-10-8-23-9-11-24)25-13-17(30-21(25)28)14-29-16-6-4-15(5-7-16)12-18(22)20(26)27/h4-7,17-19,23H,2-3,8-14,22H2,1H3,(H,26,27)