4-chloranyl-N-[2-[2-(3,4-dimethoxyphenyl)piperidin-1-yl]ethyl]-3-fluoranyl-aniline

Systemtic Name: 4-chloranyl-N-[2-[2-(3,4-dimethoxyphenyl)piperidin-1-yl]ethyl]-3-fluoranyl-aniline Openeye Name: 4-chloro-N-[2-[2-(3,4-dimethoxyphenyl)-1-piperidyl]ethyl]-3-fluoro-aniline CAS Name: 4-chloro-N-[2-[2-(3,4-dimethoxyphenyl)-1-piperidinyl]ethyl]-3-fluoroaniline IUPAC Name: 4-chloro-N-[2-[2-(3,4-dimethoxyphenyl)piperidin-1-yl]ethyl]-3-fluoroaniline Traditional Name: (4-chloro-3-fluoro-phenyl)-[2-[2-(3,4-dimethoxyphenyl)piperidino]ethyl]amine Formula: C21H26ClFN2O2 MolecularWeight: 392.894743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCCN2CCNC3=CC(=C(C=C3)Cl)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCCN2CCNC3=CC(=C(C=C3)Cl)F)OC

InChI

InChI=1S/C21H26ClFN2O2/c1-26-20-9-6-15(13-21(20)27-2)19-5-3-4-11-25(19)12-10-24-16-7-8-17(22)18(23)14-16/h6-9,13-14,19,24H,3-5,10-12H2,1-2H3