4-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-methyl-piperidin-4-ol

Systemtic Name: 4-[4-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-methyl-piperidin-4-ol Openeye Name: 4-[4-[(2-chloro-6-fluoro-phenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-methyl-piperidin-4-ol CAS Name: 4-[4-[(2-chloro-6-fluorophenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-methyl-4-piperidinol IUPAC Name: 4-[4-[(2-chloro-6-fluorophenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-methylpiperidin-4-ol Traditional Name: 4-[4-(2-chloro-6-fluoro-benzyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-1-methyl-piperidin-4-ol Formula: C22H26ClFN2O2 MolecularWeight: 404.905443

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)(C2=CC3=C(C=C2)OCCN(C3)CC4=C(C=CC=C4Cl)F)O

Isomeric SMILES

CN1CCC(CC1)(C2=CC3=C(C=C2)OCCN(C3)CC4=C(C=CC=C4Cl)F)O

InChI

InChI=1S/C22H26ClFN2O2/c1-25-9-7-22(27,8-10-25)17-5-6-21-16(13-17)14-26(11-12-28-21)15-18-19(23)3-2-4-20(18)24/h2-6,13,27H,7-12,14-15H2,1H3