ethyl 3-[2-[3-[1-(2-methylpropanoylamino)propan-2-ylamino]-2-oxidanyl-propoxy]phenyl]propanoate

Systemtic Name: ethyl 3-[2-[3-[1-(2-methylpropanoylamino)propan-2-ylamino]-2-oxidanyl-propoxy]phenyl]propanoate Openeye Name: ethyl 3-[2-[2-hydroxy-3-[[1-methyl-2-(2-methylpropanoylamino)ethyl]amino]propoxy]phenyl]propanoate CAS Name: 3-[2-[2-hydroxy-3-[1-[(2-methyl-1-oxopropyl)amino]propan-2-ylamino]propoxy]phenyl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-[2-hydroxy-3-[1-(2-methylpropanoylamino)propan-2-ylamino]propoxy]phenyl]propanoate Traditional Name: 3-[2-[2-hydroxy-3-[[2-(isobutyrylamino)-1-methyl-ethyl]amino]propoxy]phenyl]propionic acid ethyl ester Formula: C21H34N2O5 MolecularWeight: 394.50506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=CC=CC=C1OCC(CNC(C)CNC(=O)C(C)C)O

Isomeric SMILES

CCOC(=O)CCC1=CC=CC=C1OCC(CNC(C)CNC(=O)C(C)C)O

InChI

InChI=1S/C21H34N2O5/c1-5-27-20(25)11-10-17-8-6-7-9-19(17)28-14-18(24)13-22-16(4)12-23-21(26)15(2)3/h6-9,15-16,18,22,24H,5,10-14H2,1-4H3,(H,23,26)