[2-(2,5-dimethylphenyl)quinolin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [2-(2,5-dimethylphenyl)quinolin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: [2-(2,5-dimethylphenyl)-4-quinolyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [2-(2,5-dimethylphenyl)-4-quinolinyl]-[4-(2-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [2-(2,5-dimethylphenyl)quinolin-4-yl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: [2-(2,5-dimethylphenyl)-4-quinolyl]-[4-(2-methoxyphenyl)piperazino]methanone Formula: C29H29N3O2 MolecularWeight: 451.55946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=CC=CC=C5OC

InChI

InChI=1S/C29H29N3O2/c1-20-12-13-21(2)23(18-20)26-19-24(22-8-4-5-9-25(22)30-26)29(33)32-16-14-31(15-17-32)27-10-6-7-11-28(27)34-3/h4-13,18-19H,14-17H2,1-3H3