2-(3,4-dichlorophenyl)-1-[5-oxidanyl-1-(piperidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone

Systemtic Name: 2-(3,4-dichlorophenyl)-1-[5-oxidanyl-1-(piperidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Openeye Name: 2-(3,4-dichlorophenyl)-1-[5-hydroxy-1-(1-piperidylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 2-(3,4-dichlorophenyl)-1-[5-hydroxy-1-(1-piperidinylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 2-(3,4-dichlorophenyl)-1-[5-hydroxy-1-(piperidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 2-(3,4-dichlorophenyl)-1-[5-hydroxy-1-(piperidinomethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C23H26Cl2N2O2 MolecularWeight: 433.37074

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2C3=C(CCN2C(=O)CC4=CC(=C(C=C4)Cl)Cl)C(=CC=C3)O

Isomeric SMILES

C1CCN(CC1)CC2C3=C(CCN2C(=O)CC4=CC(=C(C=C4)Cl)Cl)C(=CC=C3)O

InChI

InChI=1S/C23H26Cl2N2O2/c24-19-8-7-16(13-20(19)25)14-23(29)27-12-9-18-17(5-4-6-22(18)28)21(27)15-26-10-2-1-3-11-26/h4-8,13,21,28H,1-3,9-12,14-15H2