3-[(2,5-dimethylphenyl)-piperazin-1-yl-methyl]quinoline

Systemtic Name: 3-[(2,5-dimethylphenyl)-piperazin-1-yl-methyl]quinoline Openeye Name: 3-[(2,5-dimethylphenyl)-piperazin-1-yl-methyl]quinoline CAS Name: 3-[(2,5-dimethylphenyl)-(1-piperazinyl)methyl]quinoline IUPAC Name: 3-[(2,5-dimethylphenyl)-piperazin-1-ylmethyl]quinoline Traditional Name: 3-[(2,5-dimethylphenyl)-piperazino-methyl]quinoline Formula: C22H25N3 MolecularWeight: 331.454

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C2=CC3=CC=CC=C3N=C2)N4CCNCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(C2=CC3=CC=CC=C3N=C2)N4CCNCC4

InChI

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