2-[[4-(3-bromophenyl)piperazin-1-yl]methyl]quinoline

Systemtic Name: 2-[[4-(3-bromophenyl)piperazin-1-yl]methyl]quinoline Openeye Name: 2-[[4-(3-bromophenyl)piperazin-1-yl]methyl]quinoline CAS Name: 2-[[4-(3-bromophenyl)-1-piperazinyl]methyl]quinoline IUPAC Name: 2-[[4-(3-bromophenyl)piperazin-1-yl]methyl]quinoline Traditional Name: 2-[[4-(3-bromophenyl)piperazino]methyl]quinoline Formula: C20H20BrN3 MolecularWeight: 382.2969

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C=C2)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C=C2)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H20BrN3/c21-17-5-3-6-19(14-17)24-12-10-23(11-13-24)15-18-9-8-16-4-1-2-7-20(16)22-18/h1-9,14H,10-13,15H2