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

Systemtic Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] Openeye Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] CAS Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] IUPAC Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] Traditional Name: 4',5-dimethylspiro[1,2,4,5-tetrahydro-2-benzazepin-2-ium-3,1'-cyclohexane] Formula: C17H26N+ MolecularWeight: 244.39504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25N/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/p+1