3-(4,5-dihydro-3H-1,2-benzodioxepin-8-yl)propan-1-amine

Systemtic Name: 3-(4,5-dihydro-3H-1,2-benzodioxepin-8-yl)propan-1-amine Openeye Name: 3-(4,5-dihydro-3H-1,2-benzodioxepin-8-yl)propan-1-amine CAS Name: 3-(4,5-dihydro-3H-1,2-benzodioxepin-8-yl)-1-propanamine IUPAC Name: 3-(4,5-dihydro-3H-1,2-benzodioxepin-8-yl)propan-1-amine Traditional Name: 3-(4,5-dihydro-3H-1,2-benzodioxepin-8-yl)propylamine Formula: C12H17NO2 MolecularWeight: 207.26888

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)CCCN)OOC1

Isomeric SMILES

C1CC2=C(C=C(C=C2)CCCN)OOC1

InChI

InChI=1S/C12H17NO2/c13-7-1-3-10-5-6-11-4-2-8-14-15-12(11)9-10/h5-6,9H,1-4,7-8,13H2