2-[[2-ethanoyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N,N-diethyl-butanamide

Systemtic Name: 2-[[2-ethanoyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N,N-diethyl-butanamide Openeye Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N,N-diethyl-butanamide CAS Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N,N-diethylbutanamide IUPAC Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N,N-diethylbutanamide Traditional Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N,N-diethyl-butyramide Formula: C25H31FN2O3 MolecularWeight: 426.523643

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(CC)CC)OC1=CC2=C(CCN(C2C3=CC(=CC=C3)F)C(=O)C)C=C1

Isomeric SMILES

CCC(C(=O)N(CC)CC)OC1=CC2=C(CCN(C2C3=CC(=CC=C3)F)C(=O)C)C=C1

InChI

InChI=1S/C25H31FN2O3/c1-5-23(25(30)27(6-2)7-3)31-21-12-11-18-13-14-28(17(4)29)24(22(18)16-21)19-9-8-10-20(26)15-19/h8-12,15-16,23-24H,5-7,13-14H2,1-4H3