ethyl 4-[3-[[2-(2-fluorophenyl)-2-oxidanyl-ethyl]amino]butyl]benzoate

Systemtic Name: ethyl 4-[3-[[2-(2-fluorophenyl)-2-oxidanyl-ethyl]amino]butyl]benzoate Openeye Name: ethyl 4-[3-[[2-(2-fluorophenyl)-2-hydroxy-ethyl]amino]butyl]benzoate CAS Name: 4-[3-[[2-(2-fluorophenyl)-2-hydroxyethyl]amino]butyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-[[2-(2-fluorophenyl)-2-hydroxyethyl]amino]butyl]benzoate Traditional Name: 4-[3-[[2-(2-fluorophenyl)-2-hydroxy-ethyl]amino]butyl]benzoic acid ethyl ester Formula: C21H26FNO3 MolecularWeight: 359.434443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)CCC(C)NCC(C2=CC=CC=C2F)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)CCC(C)NCC(C2=CC=CC=C2F)O

InChI

InChI=1S/C21H26FNO3/c1-3-26-21(25)17-12-10-16(11-13-17)9-8-15(2)23-14-20(24)18-6-4-5-7-19(18)22/h4-7,10-13,15,20,23-24H,3,8-9,14H2,1-2H3