[6-chloranyl-2-(2,4-dimethylphenyl)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone

Systemtic Name: [6-chloranyl-2-(2,4-dimethylphenyl)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Openeye Name: [6-chloro-2-(2,4-dimethylphenyl)-4-quinolyl]-(4-phenylpiperazin-1-yl)methanone CAS Name: [6-chloro-2-(2,4-dimethylphenyl)-4-quinolinyl]-(4-phenyl-1-piperazinyl)methanone IUPAC Name: [6-chloro-2-(2,4-dimethylphenyl)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone Traditional Name: [6-chloro-2-(2,4-dimethylphenyl)-4-quinolyl]-(4-phenylpiperazino)methanone Formula: C28H26ClN3O MolecularWeight: 455.97854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5)C

InChI

InChI=1S/C28H26ClN3O/c1-19-8-10-23(20(2)16-19)27-18-25(24-17-21(29)9-11-26(24)30-27)28(33)32-14-12-31(13-15-32)22-6-4-3-5-7-22/h3-11,16-18H,12-15H2,1-2H3