ethyl 2-[3-[2-(2-methylpropanoylamino)ethylamino]-2-oxidanyl-propoxy]benzoate

Systemtic Name: ethyl 2-[3-[2-(2-methylpropanoylamino)ethylamino]-2-oxidanyl-propoxy]benzoate Openeye Name: ethyl 2-[2-hydroxy-3-[2-(2-methylpropanoylamino)ethylamino]propoxy]benzoate CAS Name: 2-[2-hydroxy-3-[2-[(2-methyl-1-oxopropyl)amino]ethylamino]propoxy]benzoic acid ethyl ester IUPAC Name: ethyl 2-[2-hydroxy-3-[2-(2-methylpropanoylamino)ethylamino]propoxy]benzoate Traditional Name: 2-[2-hydroxy-3-[2-(isobutyrylamino)ethylamino]propoxy]benzoic acid ethyl ester Formula: C18H28N2O5 MolecularWeight: 352.42532

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1OCC(CNCCNC(=O)C(C)C)O

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1OCC(CNCCNC(=O)C(C)C)O

InChI

InChI=1S/C18H28N2O5/c1-4-24-18(23)15-7-5-6-8-16(15)25-12-14(21)11-19-9-10-20-17(22)13(2)3/h5-8,13-14,19,21H,4,9-12H2,1-3H3,(H,20,22)