N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-amine Traditional Name: (2-chloro-6-fluoro-benzyl)-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)amine Formula: C16H15ClFNO2 MolecularWeight: 307.747203

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NCC3=C(C=CC=C3Cl)F)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NCC3=C(C=CC=C3Cl)F)OC1

InChI

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