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

Systemtic Name: (3,4-dichlorophenyl)-[5-oxidanyl-1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Openeye Name: (3,4-dichlorophenyl)-[5-hydroxy-1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone CAS Name: (3,4-dichlorophenyl)-[5-hydroxy-1-(1-pyrrolidinylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone IUPAC Name: (3,4-dichlorophenyl)-[5-hydroxy-1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Traditional Name: (3,4-dichlorophenyl)-[5-hydroxy-1-(pyrrolidinomethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone Formula: C21H22Cl2N2O2 MolecularWeight: 405.31758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2C3=C(CCN2C(=O)C4=CC(=C(C=C4)Cl)Cl)C(=CC=C3)O

Isomeric SMILES

C1CCN(C1)CC2C3=C(CCN2C(=O)C4=CC(=C(C=C4)Cl)Cl)C(=CC=C3)O

InChI

InChI=1S/C21H22Cl2N2O2/c22-17-7-6-14(12-18(17)23)21(27)25-11-8-16-15(4-3-5-20(16)26)19(25)13-24-9-1-2-10-24/h3-7,12,19,26H,1-2,8-11,13H2