2-chloranyl-3-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-7-methoxy-quinoline

Systemtic Name: 2-chloranyl-3-[[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-7-methoxy-quinoline Openeye Name: 2-chloro-3-[[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methyl]-7-methoxy-quinoline CAS Name: 2-chloro-3-[[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methyl]-7-methoxyquinoline IUPAC Name: 2-chloro-3-[[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methyl]-7-methoxyquinoline Traditional Name: 2-chloro-3-[[4-(3-fluoro-4-methoxy-benzyl)piperazino]methyl]-7-methoxy-quinoline Formula: C23H25ClFN3O2 MolecularWeight: 429.914903

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=NC(=C(C=C2C=C1)CN3CCN(CC3)CC4=CC(=C(C=C4)OC)F)Cl

Isomeric SMILES

COC1=CC2=NC(=C(C=C2C=C1)CN3CCN(CC3)CC4=CC(=C(C=C4)OC)F)Cl

InChI

InChI=1S/C23H25ClFN3O2/c1-29-19-5-4-17-12-18(23(24)26-21(17)13-19)15-28-9-7-27(8-10-28)14-16-3-6-22(30-2)20(25)11-16/h3-6,11-13H,7-10,14-15H2,1-2H3