7,8-dimethoxy-2-(phenylmethyl)-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium

Systemtic Name: 7,8-dimethoxy-2-(phenylmethyl)-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium Openeye Name: 2-benzyl-7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium CAS Name: 7,8-dimethoxy-2-(phenylmethyl)-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium IUPAC Name: 2-benzyl-7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium Traditional Name: 2-benzyl-7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium Formula: C19H24NO2+ MolecularWeight: 298.39936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH+](CCCC2=C1)CC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C=C2C[NH+](CCCC2=C1)CC3=CC=CC=C3)OC

InChI

InChI=1S/C19H23NO2/c1-21-18-11-16-9-6-10-20(13-15-7-4-3-5-8-15)14-17(16)12-19(18)22-2/h3-5,7-8,11-12H,6,9-10,13-14H2,1-2H3/p+1