[6-bromanyl-2-(4-butylphenyl)quinolin-4-yl]-(4-methylpiperazin-1-yl)methanone

Systemtic Name: [6-bromanyl-2-(4-butylphenyl)quinolin-4-yl]-(4-methylpiperazin-1-yl)methanone Openeye Name: [6-bromo-2-(4-butylphenyl)-4-quinolyl]-(4-methylpiperazin-1-yl)methanone CAS Name: [6-bromo-2-(4-butylphenyl)-4-quinolinyl]-(4-methyl-1-piperazinyl)methanone IUPAC Name: [6-bromo-2-(4-butylphenyl)quinolin-4-yl]-(4-methylpiperazin-1-yl)methanone Traditional Name: [6-bromo-2-(4-butylphenyl)-4-quinolyl]-(4-methylpiperazino)methanone Formula: C25H28BrN3O MolecularWeight: 466.41332

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C25H28BrN3O/c1-3-4-5-18-6-8-19(9-7-18)24-17-22(21-16-20(26)10-11-23(21)27-24)25(30)29-14-12-28(2)13-15-29/h6-11,16-17H,3-5,12-15H2,1-2H3