2-[[2-ethanoyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-ethanoylpiperazin-1-yl)propan-1-one

Systemtic Name: 2-[[2-ethanoyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-ethanoylpiperazin-1-yl)propan-1-one Openeye Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-acetylpiperazin-1-yl)propan-1-one CAS Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-acetyl-1-piperazinyl)-1-propanone IUPAC Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-acetylpiperazin-1-yl)propan-1-one Traditional Name: 2-[[2-acetyl-1-(3-fluorophenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-acetylpiperazino)propan-1-one Formula: C26H30FN3O4 MolecularWeight: 467.532503

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCN(CC1)C(=O)C)OC2=CC3=C(CCN(C3C4=CC(=CC=C4)F)C(=O)C)C=C2

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(=O)C)OC2=CC3=C(CCN(C3C4=CC(=CC=C4)F)C(=O)C)C=C2

InChI

InChI=1S/C26H30FN3O4/c1-17(26(33)29-13-11-28(12-14-29)18(2)31)34-23-8-7-20-9-10-30(19(3)32)25(24(20)16-23)21-5-4-6-22(27)15-21/h4-8,15-17,25H,9-14H2,1-3H3