[6-bromanyl-2-(4-butylphenyl)quinolin-4-yl]-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: [6-bromanyl-2-(4-butylphenyl)quinolin-4-yl]-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]methanone Openeye Name: [6-bromo-2-(4-butylphenyl)-4-quinolyl]-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]methanone CAS Name: [6-bromo-2-(4-butylphenyl)-4-quinolinyl]-[4-[(4-ethylphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: [6-bromo-2-(4-butylphenyl)quinolin-4-yl]-[4-[(4-ethylphenyl)methyl]piperazin-1-yl]methanone Traditional Name: [6-bromo-2-(4-butylphenyl)-4-quinolyl]-[4-(4-ethylbenzyl)piperazino]methanone Formula: C33H36BrN3O MolecularWeight: 570.56244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)CC5=CC=C(C=C5)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)N4CCN(CC4)CC5=CC=C(C=C5)CC

InChI

InChI=1S/C33H36BrN3O/c1-3-5-6-25-11-13-27(14-12-25)32-22-30(29-21-28(34)15-16-31(29)35-32)33(38)37-19-17-36(18-20-37)23-26-9-7-24(4-2)8-10-26/h7-16,21-22H,3-6,17-20,23H2,1-2H3