N-(furan-2-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine

Systemtic Name: N-(furan-2-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Openeye Name: N-(2-furylmethyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine CAS Name: N-(2-furanylmethyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine IUPAC Name: N-(furan-2-ylmethyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Traditional Name: 2-furfuryl(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)amine Formula: C11H17N2O+ MolecularWeight: 193.26548

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[NH+]CC1)NCC2=CC=CO2

Isomeric SMILES

C1CCC(=[NH+]CC1)NCC2=CC=CO2

InChI

InChI=1S/C11H16N2O/c1-2-6-11(12-7-3-1)13-9-10-5-4-8-14-10/h4-5,8H,1-3,6-7,9H2,(H,12,13)/p+1