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

Systemtic Name: N-(3-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Openeye Name: N-(m-tolyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine CAS Name: N-(3-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine IUPAC Name: N-(3-methylphenyl)-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine Traditional Name: m-tolyl(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)amine Formula: C13H19N2+ MolecularWeight: 203.30336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=[NH+]CCCCC2

Isomeric SMILES

CC1=CC(=CC=C1)NC2=[NH+]CCCCC2

InChI

InChI=1S/C13H18N2/c1-11-6-5-7-12(10-11)15-13-8-3-2-4-9-14-13/h5-7,10H,2-4,8-9H2,1H3,(H,14,15)/p+1