1-[4-[(4-fluorophenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-3-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]propan-1-one dihydrochloride

Systemtic Name: 1-[4-[(4-fluorophenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-3-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]propan-1-one dihydrochloride Openeye Name: 1-[4-[(4-fluorophenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-3-[1-[(2-fluorophenyl)methyl]-4-piperidyl]propan-1-one dihydrochloride CAS Name: 1-[4-[(4-fluorophenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-3-[1-[(2-fluorophenyl)methyl]-4-piperidinyl]-1-propanone dihydrochloride IUPAC Name: 1-[4-[(4-fluorophenyl)methyl]-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-3-[1-[(2-fluorophenyl)methyl]piperidin-4-yl]propan-1-one dihydrochloride Traditional Name: 1-[4-(4-fluorobenzyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]-3-[1-(2-fluorobenzyl)-4-piperidyl]propan-1-one dihydrochloride Formula: C31H36Cl2F2N2O2 MolecularWeight: 577.532546

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CCC(=O)C2=CC3=C(C=C2)OCCN(C3)CC4=CC=C(C=C4)F)CC5=CC=CC=C5F.Cl.Cl

Isomeric SMILES

C1CN(CCC1CCC(=O)C2=CC3=C(C=C2)OCCN(C3)CC4=CC=C(C=C4)F)CC5=CC=CC=C5F.Cl.Cl

InChI

InChI=1S/C31H34F2N2O2.2ClH/c32-28-9-5-24(6-10-28)20-35-17-18-37-31-12-8-25(19-27(31)22-35)30(36)11-7-23-13-15-34(16-14-23)21-26-3-1-2-4-29(26)33;;/h1-6,8-10,12,19,23H,7,11,13-18,20-22H2;2*1H