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

Systemtic Name: N-(2,4-dimethoxyphenyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Openeye Name: N-(2,4-dimethoxyphenyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine CAS Name: N-(2,4-dimethoxyphenyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine IUPAC Name: N-(2,4-dimethoxyphenyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Traditional Name: (2,4-dimethoxyphenyl)-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)amine Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)NC2=[NH+]CCCCC2)OC

Isomeric SMILES

COC1=CC(=C(C=C1)NC2=[NH+]CCCCC2)OC

InChI

InChI=1S/C14H20N2O2/c1-17-11-7-8-12(13(10-11)18-2)16-14-6-4-3-5-9-15-14/h7-8,10H,3-6,9H2,1-2H3,(H,15,16)/p+1