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

Systemtic Name: 2-[[2-ethanoyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)propanamide Openeye Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-isopentyl-propanamide CAS Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)propanamide IUPAC Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)propanamide Traditional Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-isoamyl-propionamide Formula: C25H31FN2O3 MolecularWeight: 426.523643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H31FN2O3/c1-16(2)10-12-27-25(30)17(3)31-22-9-8-19-11-13-28(18(4)29)24(23(19)15-22)20-6-5-7-21(26)14-20/h5-9,14-17,24H,10-13H2,1-4H3,(H,27,30)