methyl 2-[2-oxidanyl-3-[2-(phenylcarbamoylamino)ethylamino]propoxy]benzoate

Systemtic Name: methyl 2-[2-oxidanyl-3-[2-(phenylcarbamoylamino)ethylamino]propoxy]benzoate Openeye Name: methyl 2-[2-hydroxy-3-[2-(phenylcarbamoylamino)ethylamino]propoxy]benzoate CAS Name: 2-[3-[2-[[anilino(oxo)methyl]amino]ethylamino]-2-hydroxypropoxy]benzoic acid methyl ester IUPAC Name: methyl 2-[2-hydroxy-3-[2-(phenylcarbamoylamino)ethylamino]propoxy]benzoate Traditional Name: 2-[2-hydroxy-3-[2-(phenylcarbamoylamino)ethylamino]propoxy]benzoic acid methyl ester Formula: C20H25N3O5 MolecularWeight: 387.4296

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1OCC(CNCCNC(=O)NC2=CC=CC=C2)O

Isomeric SMILES

COC(=O)C1=CC=CC=C1OCC(CNCCNC(=O)NC2=CC=CC=C2)O

InChI

InChI=1S/C20H25N3O5/c1-27-19(25)17-9-5-6-10-18(17)28-14-16(24)13-21-11-12-22-20(26)23-15-7-3-2-4-8-15/h2-10,16,21,24H,11-14H2,1H3,(H2,22,23,26)