N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-3-iodanyl-aniline

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-3-iodanyl-aniline Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-3-iodo-aniline CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-3-iodoaniline IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl)-3-iodoaniline Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-6-ylmethyl-(3-iodophenyl)amine Formula: C16H16INO2 MolecularWeight: 381.20821

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=CC=CC(=C2OC1)CNC3=CC(=CC=C3)I

Isomeric SMILES

C1COC2=CC=CC(=C2OC1)CNC3=CC(=CC=C3)I

InChI

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