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

Systemtic Name: 3-[[4-(2,4-dimethylphenyl)piperazin-1-yl]methyl]quinoline Openeye Name: 3-[[4-(2,4-dimethylphenyl)piperazin-1-yl]methyl]quinoline CAS Name: 3-[[4-(2,4-dimethylphenyl)-1-piperazinyl]methyl]quinoline IUPAC Name: 3-[[4-(2,4-dimethylphenyl)piperazin-1-yl]methyl]quinoline Traditional Name: 3-[[4-(2,4-dimethylphenyl)piperazino]methyl]quinoline Formula: C22H25N3 MolecularWeight: 331.454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC4=CC=CC=C4N=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCN(CC2)CC3=CC4=CC=CC=C4N=C3)C

InChI

InChI=1S/C22H25N3/c1-17-7-8-22(18(2)13-17)25-11-9-24(10-12-25)16-19-14-20-5-3-4-6-21(20)23-15-19/h3-8,13-15H,9-12,16H2,1-2H3