(6-bromanyl-2-phenyl-quinolin-4-yl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (6-bromanyl-2-phenyl-quinolin-4-yl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone Openeye Name: (6-bromo-2-phenyl-4-quinolyl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone CAS Name: (6-bromo-2-phenyl-4-quinolinyl)-[4-[(2,5-dimethoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (6-bromo-2-phenylquinolin-4-yl)-[4-[(2,5-dimethoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (6-bromo-2-phenyl-4-quinolyl)-[4-(2,5-dimethoxybenzyl)piperazino]methanone Formula: C29H28BrN3O3 MolecularWeight: 546.45492

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN2CCN(CC2)C(=O)C3=CC(=NC4=C3C=C(C=C4)Br)C5=CC=CC=C5

InChI

InChI=1S/C29H28BrN3O3/c1-35-23-9-11-28(36-2)21(16-23)19-32-12-14-33(15-13-32)29(34)25-18-27(20-6-4-3-5-7-20)31-26-10-8-22(30)17-24(25)26/h3-11,16-18H,12-15,19H2,1-2H3