(1S)-1,5,5-trimethyl-8-nitro-spiro[2,4-dihydro-1H-2-benzazepin-2-ium-3,1'-cyclohexane]

Systemtic Name: (1S)-1,5,5-trimethyl-8-nitro-spiro[2,4-dihydro-1H-2-benzazepin-2-ium-3,1'-cyclohexane] Openeye Name: (1S)-1,5,5-trimethyl-8-nitro-spiro[2,4-dihydro-1H-2-benzazepin-2-ium-3,1'-cyclohexane] CAS Name: (1S)-1,5,5-trimethyl-8-nitrospiro[2,4-dihydro-1H-2-benzazepin-2-ium-3,1'-cyclohexane] IUPAC Name: (1S)-1,5,5-trimethyl-8-nitrospiro[2,4-dihydro-1H-2-benzazepin-2-ium-3,1'-cyclohexane] Traditional Name: (1S)-1,5,5-trimethyl-8-nitro-spiro[2,4-dihydro-1H-2-benzazepin-2-ium-3,1'-cyclohexane] Formula: C18H27N2O2+ MolecularWeight: 303.41918

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=CC(=C2)[N+](=O)[O-])C(CC3([NH2+]1)CCCCC3)(C)C

Isomeric SMILES

C[C@H]1C2=C(C=CC(=C2)[N+](=O)[O-])C(CC3([NH2+]1)CCCCC3)(C)C

InChI

InChI=1S/C18H26N2O2/c1-13-15-11-14(20(21)22)7-8-16(15)17(2,3)12-18(19-13)9-5-4-6-10-18/h7-8,11,13,19H,4-6,9-10,12H2,1-3H3/p+1/t13-/m0/s1