[(R)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-iodanylphenyl)methyl]azanium

Systemtic Name: [(R)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-iodanylphenyl)methyl]azanium Openeye Name: [(R)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-iodophenyl)methyl]ammonium CAS Name: [(R)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-iodophenyl)methyl]ammonium IUPAC Name: [(R)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-iodophenyl)methyl]azanium Traditional Name: [(R)-3,4-dihydro-2H-1,5-benzodioxepin-7-yl-(2-iodophenyl)methyl]ammonium Formula: C16H17INO2+ MolecularWeight: 382.21615

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(C3=CC=CC=C3I)[NH3+])OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)[C@H](C3=CC=CC=C3I)[NH3+])OC1

InChI

InChI=1S/C16H16INO2/c17-13-5-2-1-4-12(13)16(18)11-6-7-14-15(10-11)20-9-3-8-19-14/h1-2,4-7,10,16H,3,8-9,18H2/p+1/t16-/m1/s1