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

Systemtic Name: 1-(4-ethanoylpiperazin-1-yl)-2-[[1-phenyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]propan-1-one Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[(2-benzyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]propan-1-one CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[[1-phenyl-2-(phenylmethyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-propanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-[(2-benzyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]propan-1-one Traditional Name: 1-(4-acetylpiperazino)-2-[(2-benzyl-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl)oxy]propan-1-one Formula: C31H35N3O3 MolecularWeight: 497.6279

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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)CC5=CC=CC=C5)C=C2

Isomeric SMILES

CC(C(=O)N1CCN(CC1)C(=O)C)OC2=CC3=C(CCN(C3C4=CC=CC=C4)CC5=CC=CC=C5)C=C2

InChI

InChI=1S/C31H35N3O3/c1-23(31(36)33-19-17-32(18-20-33)24(2)35)37-28-14-13-26-15-16-34(22-25-9-5-3-6-10-25)30(29(26)21-28)27-11-7-4-8-12-27/h3-14,21,23,30H,15-20,22H2,1-2H3