methyl 4-[[[3-(3-morpholin-4-yl-2-oxidanyl-propoxy)phenyl]methylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[3-(3-morpholin-4-yl-2-oxidanyl-propoxy)phenyl]methylamino]methyl]benzoate Openeye Name: methyl 4-[[[3-(2-hydroxy-3-morpholino-propoxy)phenyl]methylamino]methyl]benzoate CAS Name: 4-[[[3-[2-hydroxy-3-(4-morpholinyl)propoxy]phenyl]methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[3-(2-hydroxy-3-morpholin-4-ylpropoxy)phenyl]methylamino]methyl]benzoate Traditional Name: 4-[[[3-(2-hydroxy-3-morpholino-propoxy)benzyl]amino]methyl]benzoic acid methyl ester Formula: C23H30N2O5 MolecularWeight: 414.4947

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNCC2=CC(=CC=C2)OCC(CN3CCOCC3)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNCC2=CC(=CC=C2)OCC(CN3CCOCC3)O

InChI

InChI=1S/C23H30N2O5/c1-28-23(27)20-7-5-18(6-8-20)14-24-15-19-3-2-4-22(13-19)30-17-21(26)16-25-9-11-29-12-10-25/h2-8,13,21,24,26H,9-12,14-17H2,1H3