(3-chloranyl-4-ethoxy-5-methoxy-phenyl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-4-ethoxy-5-methoxy-phenyl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: (3-chloro-4-ethoxy-5-methoxy-phenyl)-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone CAS Name: (3-chloro-4-ethoxy-5-methoxyphenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-chloro-4-ethoxy-5-methoxyphenyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (3-chloro-4-ethoxy-5-methoxy-phenyl)-[4-(3-fluoro-4-methoxy-benzyl)piperazino]methanone Formula: C22H26ClFN2O4 MolecularWeight: 436.904243

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F)OC

InChI

InChI=1S/C22H26ClFN2O4/c1-4-30-21-17(23)12-16(13-20(21)29-3)22(27)26-9-7-25(8-10-26)14-15-5-6-19(28-2)18(24)11-15/h5-6,11-13H,4,7-10,14H2,1-3H3