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

Systemtic Name: 2-[[2-ethanoyl-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-N-(phenylmethyl)butanamide Openeye Name: 2-[[2-acetyl-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-benzyl-N-methyl-butanamide CAS Name: 2-[[2-acetyl-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-methyl-N-(phenylmethyl)butanamide IUPAC Name: 2-[[2-acetyl-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-benzyl-N-methylbutanamide Traditional Name: 2-[[2-acetyl-1-(4-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-benzyl-N-methyl-butyramide Formula: C29H31FN2O3 MolecularWeight: 474.566443

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(C)CC1=CC=CC=C1)OC2=CC3=C(CCN(C3C4=CC=C(C=C4)F)C(=O)C)C=C2

Isomeric SMILES

CCC(C(=O)N(C)CC1=CC=CC=C1)OC2=CC3=C(CCN(C3C4=CC=C(C=C4)F)C(=O)C)C=C2

InChI

InChI=1S/C29H31FN2O3/c1-4-27(29(34)31(3)19-21-8-6-5-7-9-21)35-25-15-12-22-16-17-32(20(2)33)28(26(22)18-25)23-10-13-24(30)14-11-23/h5-15,18,27-28H,4,16-17,19H2,1-3H3