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

Systemtic Name: 2-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enyl-butanamide Openeye Name: N-allyl-2-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butanamide CAS Name: 2-[[1-(3-fluorophenyl)-2-(3-methyl-1-oxobutyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enylbutanamide IUPAC Name: 2-[[1-(3-fluorophenyl)-2-(3-methylbutanoyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enylbutanamide Traditional Name: N-allyl-2-[[1-(3-fluorophenyl)-2-isovaleryl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butyramide Formula: C27H33FN2O3 MolecularWeight: 452.560923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33FN2O3/c1-5-13-29-27(32)24(6-2)33-22-11-10-19-12-14-30(25(31)15-18(3)4)26(23(19)17-22)20-8-7-9-21(28)16-20/h5,7-11,16-18,24,26H,1,6,12-15H2,2-4H3,(H,29,32)