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

Systemtic Name: N-[(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-iodanyl-aniline Openeye Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-iodo-aniline CAS Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-iodoaniline IUPAC Name: N-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2-iodoaniline Traditional Name: (6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl-(2-iodophenyl)amine Formula: C16H15ClINO2 MolecularWeight: 415.65327

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C(=CC(=C2)CNC3=CC=CC=C3I)Cl)OC1

Isomeric SMILES

C1COC2=C(C(=CC(=C2)CNC3=CC=CC=C3I)Cl)OC1

InChI

InChI=1S/C16H15ClINO2/c17-12-8-11(9-15-16(12)21-7-3-6-20-15)10-19-14-5-2-1-4-13(14)18/h1-2,4-5,8-9,19H,3,6-7,10H2