1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-(phenylmethyl)azanium

Systemtic Name: 1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-(phenylmethyl)azanium Openeye Name: benzyl(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)ammonium CAS Name: 1,5-dihydro-2,4-benzodioxepin-3-ylmethyl-(phenylmethyl)ammonium IUPAC Name: benzyl(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)azanium Traditional Name: benzyl(1,5-dihydro-2,4-benzodioxepin-3-ylmethyl)ammonium Formula: C17H20NO2+ MolecularWeight: 270.3462

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=CC=CC=C2COC(O1)C[NH2+]CC3=CC=CC=C3

Isomeric SMILES

C1C2=CC=CC=C2COC(O1)C[NH2+]CC3=CC=CC=C3

InChI

InChI=1S/C17H19NO2/c1-2-6-14(7-3-1)10-18-11-17-19-12-15-8-4-5-9-16(15)13-20-17/h1-9,17-18H,10-13H2/p+1