4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] chloride

Systemtic Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] chloride Openeye Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] chloride CAS Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] chloride IUPAC Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] chloride Traditional Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] chloride Formula: C17H26ClN MolecularWeight: 279.84804

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2(CC1)CC(C3=CC=CC=C3C[NH2+]2)C.[Cl-]

Isomeric SMILES

CC1CCC2(CC1)CC(C3=CC=CC=C3C[NH2+]2)C.[Cl-]

InChI

InChI=1S/C17H25N.ClH/c1-13-7-9-17(10-8-13)11-14(2)16-6-4-3-5-15(16)12-18-17;/h3-6,13-14,18H,7-12H2,1-2H3;1H