N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-fluoranyl-aniline

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-fluoranyl-aniline Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-fluoro-aniline CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-fluoroaniline IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-3-fluoroaniline Traditional Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-(3-fluorophenyl)amine Formula: C16H15ClFNO2 MolecularWeight: 307.747203

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC3=CC(=CC=C3)F)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC3=CC(=CC=C3)F)Cl)OC1

InChI

InChI=1S/C16H15ClFNO2/c17-14-7-11(8-15-16(14)21-6-2-5-20-15)10-19-13-4-1-3-12(18)9-13/h1,3-4,7-9,19H,2,5-6,10H2