3,3,5-trimethyl-1,2,4,5-tetrahydro-2-benzazepin-2-ium

Systemtic Name: 3,3,5-trimethyl-1,2,4,5-tetrahydro-2-benzazepin-2-ium Openeye Name: 3,3,5-trimethyl-1,2,4,5-tetrahydro-2-benzazepin-2-ium CAS Name: 3,3,5-trimethyl-1,2,4,5-tetrahydro-2-benzazepin-2-ium IUPAC Name: 3,3,5-trimethyl-1,2,4,5-tetrahydro-2-benzazepin-2-ium Traditional Name: 3,3,5-trimethyl-1,2,4,5-tetrahydro-2-benzazepin-2-ium Formula: C13H20N+ MolecularWeight: 190.3046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC([NH2+]CC2=CC=CC=C12)(C)C

Isomeric SMILES

CC1CC([NH2+]CC2=CC=CC=C12)(C)C

InChI

InChI=1S/C13H19N/c1-10-8-13(2,3)14-9-11-6-4-5-7-12(10)11/h4-7,10,14H,8-9H2,1-3H3/p+1