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

Systemtic Name: 2-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enyl-butanamide Openeye Name: N-allyl-2-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butanamide CAS Name: 2-[[1-(3-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enylbutanamide IUPAC Name: 2-[[1-(3-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enylbutanamide Traditional Name: N-allyl-2-[[1-(3-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butyramide Formula: C25H29FN2O3 MolecularWeight: 424.507763

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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=C1

Isomeric SMILES

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

InChI

InChI=1S/C25H29FN2O3/c1-4-13-27-25(30)22(5-2)31-20-11-10-17-12-14-28(23(29)6-3)24(21(17)16-20)18-8-7-9-19(26)15-18/h4,7-11,15-16,22,24H,1,5-6,12-14H2,2-3H3,(H,27,30)