2,2-bis(4-chlorophenyl)-1-[1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone

Systemtic Name: 2,2-bis(4-chlorophenyl)-1-[1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Openeye Name: 2,2-bis(4-chlorophenyl)-1-[1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 2,2-bis(4-chlorophenyl)-1-[1-(1-pyrrolidinylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 2,2-bis(4-chlorophenyl)-1-[1-(pyrrolidin-1-ylmethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 2,2-bis(4-chlorophenyl)-1-[1-(pyrrolidinomethyl)-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C28H28Cl2N2O MolecularWeight: 479.44072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2C3=CC=CC=C3CCN2C(=O)C(C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CCN(C1)CC2C3=CC=CC=C3CCN2C(=O)C(C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H28Cl2N2O/c29-23-11-7-21(8-12-23)27(22-9-13-24(30)14-10-22)28(33)32-18-15-20-5-1-2-6-25(20)26(32)19-31-16-3-4-17-31/h1-2,5-14,26-27H,3-4,15-19H2