N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)amine Formula: C14H19N2O2+ MolecularWeight: 247.31286

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[NH+]CC1)NC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C1CCC(=[NH+]CC1)NC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C14H18N2O2/c1-2-4-14(15-7-3-1)16-11-5-6-12-13(10-11)18-9-8-17-12/h5-6,10H,1-4,7-9H2,(H,15,16)/p+1