N-ethyl-2-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-butanamide

Systemtic Name: N-ethyl-2-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-butanamide Openeye Name: N-ethyl-2-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-butanamide CAS Name: N-ethyl-2-[[1-(3-fluorophenyl)-2-(3-methyl-1-oxobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methylbutanamide IUPAC Name: N-ethyl-2-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methylbutanamide Traditional Name: N-ethyl-2-[[1-(3-fluorophenyl)-2-isovaleryl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-butyramide Formula: C27H35FN2O3 MolecularWeight: 454.576803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H35FN2O3/c1-6-24(27(32)29(5)7-2)33-22-12-11-19-13-14-30(25(31)15-18(3)4)26(23(19)17-22)20-9-8-10-21(28)16-20/h8-12,16-18,24,26H,6-7,13-15H2,1-5H3