[6-bromanyl-2-(4-propoxyphenyl)quinolin-4-yl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone

Systemtic Name: [6-bromanyl-2-(4-propoxyphenyl)quinolin-4-yl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone Openeye Name: [6-bromo-2-(4-propoxyphenyl)-4-quinolyl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone CAS Name: [6-bromo-2-(4-propoxyphenyl)-4-quinolinyl]-[4-(3-chlorophenyl)-1-piperazinyl]methanone IUPAC Name: [6-bromo-2-(4-propoxyphenyl)quinolin-4-yl]-[4-(3-chlorophenyl)piperazin-1-yl]methanone Traditional Name: [6-bromo-2-(4-propoxyphenyl)-4-quinolyl]-[4-(3-chlorophenyl)piperazino]methanone Formula: C29H27BrClN3O2 MolecularWeight: 564.90058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

Isomeric SMILES

CCCOC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)C5=CC(=CC=C5)Cl

InChI

InChI=1S/C29H27BrClN3O2/c1-2-16-36-24-9-6-20(7-10-24)28-19-26(25-17-21(30)8-11-27(25)32-28)29(35)34-14-12-33(13-15-34)23-5-3-4-22(31)18-23/h3-11,17-19H,2,12-16H2,1H3