1-[2-(3,4-dichlorophenyl)-4-phenyl-1-(pyrrolidin-1-ylmethyl)-3,4-dihydroisoquinolin-1-yl]ethanone

Systemtic Name: 1-[2-(3,4-dichlorophenyl)-4-phenyl-1-(pyrrolidin-1-ylmethyl)-3,4-dihydroisoquinolin-1-yl]ethanone Openeye Name: 1-[2-(3,4-dichlorophenyl)-4-phenyl-1-(pyrrolidin-1-ylmethyl)-3,4-dihydroisoquinolin-1-yl]ethanone CAS Name: 1-[2-(3,4-dichlorophenyl)-4-phenyl-1-(1-pyrrolidinylmethyl)-3,4-dihydroisoquinolin-1-yl]ethanone IUPAC Name: 1-[2-(3,4-dichlorophenyl)-4-phenyl-1-(pyrrolidin-1-ylmethyl)-3,4-dihydroisoquinolin-1-yl]ethanone Traditional Name: 1-[2-(3,4-dichlorophenyl)-4-phenyl-1-(pyrrolidinomethyl)-3,4-dihydroisoquinolin-1-yl]ethanone Formula: C28H28Cl2N2O MolecularWeight: 479.44072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1(C2=CC=CC=C2C(CN1C3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4)CN5CCCC5

Isomeric SMILES

CC(=O)C1(C2=CC=CC=C2C(CN1C3=CC(=C(C=C3)Cl)Cl)C4=CC=CC=C4)CN5CCCC5

InChI

InChI=1S/C28H28Cl2N2O/c1-20(33)28(19-31-15-7-8-16-31)25-12-6-5-11-23(25)24(21-9-3-2-4-10-21)18-32(28)22-13-14-26(29)27(30)17-22/h2-6,9-14,17,24H,7-8,15-16,18-19H2,1H3