3-(6H-benzo[b][1,4]benzodioxepin-6-yl)propan-1-amine

Systemtic Name: 3-(6H-benzo[b][1,4]benzodioxepin-6-yl)propan-1-amine Openeye Name: 3-(6H-benzo[b][1,4]benzodioxepin-6-yl)propan-1-amine CAS Name: 3-(6H-benzo[b][1,4]benzodioxepin-6-yl)-1-propanamine IUPAC Name: 3-(6H-benzo[b][1,4]benzodioxepin-6-yl)propan-1-amine Traditional Name: 3-(6H-benzo[b][1,4]benzodioxepin-6-yl)propylamine Formula: C16H17NO2 MolecularWeight: 255.31168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(OC3=CC=CC=C3O2)CCCN

Isomeric SMILES

C1=CC=C2C(=C1)C(OC3=CC=CC=C3O2)CCCN

InChI

InChI=1S/C16H17NO2/c17-11-5-10-14-12-6-1-2-7-13(12)18-15-8-3-4-9-16(15)19-14/h1-4,6-9,14H,5,10-11,17H2