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

Systemtic Name: 7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium Openeye Name: 7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium CAS Name: 7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium IUPAC Name: 7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium Traditional Name: 7,8-dimethoxy-2,3,4,5-tetrahydro-1H-2-benzazepin-2-ium Formula: C12H18NO2+ MolecularWeight: 208.27682

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C[NH2+]CCCC2=C1)OC

Isomeric SMILES

COC1=C(C=C2C[NH2+]CCCC2=C1)OC

InChI

InChI=1S/C12H17NO2/c1-14-11-6-9-4-3-5-13-8-10(9)7-12(11)15-2/h6-7,13H,3-5,8H2,1-2H3/p+1