ethyl 4-[3-[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]-2-oxidanyl-propoxy]benzoate

Systemtic Name: ethyl 4-[3-[(3-fluoranyl-4-methoxy-phenyl)methyl-methyl-amino]-2-oxidanyl-propoxy]benzoate Openeye Name: ethyl 4-[3-[(3-fluoro-4-methoxy-phenyl)methyl-methyl-amino]-2-hydroxy-propoxy]benzoate CAS Name: 4-[3-[(3-fluoro-4-methoxyphenyl)methyl-methylamino]-2-hydroxypropoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[(3-fluoro-4-methoxyphenyl)methyl-methylamino]-2-hydroxypropoxy]benzoate Traditional Name: 4-[3-[(3-fluoro-4-methoxy-benzyl)-methyl-amino]-2-hydroxy-propoxy]benzoic acid ethyl ester Formula: C21H26FNO5 MolecularWeight: 391.433243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(CN(C)CC2=CC(=C(C=C2)OC)F)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC(CN(C)CC2=CC(=C(C=C2)OC)F)O

InChI

InChI=1S/C21H26FNO5/c1-4-27-21(25)16-6-8-18(9-7-16)28-14-17(24)13-23(2)12-15-5-10-20(26-3)19(22)11-15/h5-11,17,24H,4,12-14H2,1-3H3