2-[[2-[(3-methylphenyl)methyl]-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-morpholin-4-yl-butan-1-one

Systemtic Name: 2-[[2-[(3-methylphenyl)methyl]-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-morpholin-4-yl-butan-1-one Openeye Name: 1-morpholino-2-[[2-(m-tolylmethyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butan-1-one CAS Name: 2-[[2-[(3-methylphenyl)methyl]-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-(4-morpholinyl)-1-butanone IUPAC Name: 2-[[2-[(3-methylphenyl)methyl]-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-morpholin-4-ylbutan-1-one Traditional Name: 2-[[2-(3-methylbenzyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-1-morpholino-butan-1-one Formula: C31H36N2O3 MolecularWeight: 484.62914

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1CCOCC1)OC2=CC3=C(CCN(C3C4=CC=CC=C4)CC5=CC=CC(=C5)C)C=C2

Isomeric SMILES

CCC(C(=O)N1CCOCC1)OC2=CC3=C(CCN(C3C4=CC=CC=C4)CC5=CC=CC(=C5)C)C=C2

InChI

InChI=1S/C31H36N2O3/c1-3-29(31(34)32-16-18-35-19-17-32)36-27-13-12-25-14-15-33(22-24-9-7-8-23(2)20-24)30(28(25)21-27)26-10-5-4-6-11-26/h4-13,20-21,29-30H,3,14-19,22H2,1-2H3