methyl 4-[3-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxidanyl-propoxy]benzoate

Systemtic Name: methyl 4-[3-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-oxidanyl-propoxy]benzoate Openeye Name: methyl 4-[3-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-hydroxy-propoxy]benzoate CAS Name: 4-[3-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-hydroxypropoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[cyclopropyl-[(2-fluorophenyl)methyl]amino]-2-hydroxypropoxy]benzoate Traditional Name: 4-[3-[cyclopropyl-(2-fluorobenzyl)amino]-2-hydroxy-propoxy]benzoic acid methyl ester Formula: C21H24FNO4 MolecularWeight: 373.417963

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC(CN(CC2=CC=CC=C2F)C3CC3)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC(CN(CC2=CC=CC=C2F)C3CC3)O

InChI

InChI=1S/C21H24FNO4/c1-26-21(25)15-6-10-19(11-7-15)27-14-18(24)13-23(17-8-9-17)12-16-4-2-3-5-20(16)22/h2-7,10-11,17-18,24H,8-9,12-14H2,1H3