3-[[4-[(4-fluorophenyl)methoxy]phenyl]methylamino]azepan-2-one

Systemtic Name: 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methylamino]azepan-2-one Openeye Name: 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methylamino]azepan-2-one CAS Name: 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methylamino]-2-azepanone IUPAC Name: 3-[[4-[(4-fluorophenyl)methoxy]phenyl]methylamino]azepan-2-one Traditional Name: 3-[[4-(4-fluorobenzyl)oxybenzyl]amino]azepan-2-one Formula: C20H23FN2O2 MolecularWeight: 342.407223

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=CC=C(C=C2)OCC3=CC=C(C=C3)F

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=CC=C(C=C2)OCC3=CC=C(C=C3)F

InChI

InChI=1S/C20H23FN2O2/c21-17-8-4-16(5-9-17)14-25-18-10-6-15(7-11-18)13-23-19-3-1-2-12-22-20(19)24/h4-11,19,23H,1-3,12-14H2,(H,22,24)