[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-[2-(4-ethoxyphenyl)quinolin-4-yl]methanone

Systemtic Name: [4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]-[2-(4-ethoxyphenyl)quinolin-4-yl]methanone Openeye Name: [4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]-[2-(4-ethoxyphenyl)-4-quinolyl]methanone CAS Name: [4-(5-chloro-2-methylphenyl)-1-piperazinyl]-[2-(4-ethoxyphenyl)-4-quinolinyl]methanone IUPAC Name: [4-(5-chloro-2-methylphenyl)piperazin-1-yl]-[2-(4-ethoxyphenyl)quinolin-4-yl]methanone Traditional Name: [4-(5-chloro-2-methyl-phenyl)piperazino]-(2-p-phenetyl-4-quinolyl)methanone Formula: C29H28ClN3O2 MolecularWeight: 486.00452

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=C(C=CC(=C5)Cl)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C5=C(C=CC(=C5)Cl)C

InChI

InChI=1S/C29H28ClN3O2/c1-3-35-23-12-9-21(10-13-23)27-19-25(24-6-4-5-7-26(24)31-27)29(34)33-16-14-32(15-17-33)28-18-22(30)11-8-20(28)2/h4-13,18-19H,3,14-17H2,1-2H3