12-tert-butyl-N,N-dimethyl-7H-indeno[1,2-b]quinolizin-5-ium-2-amine; methanesulfonate

Systemtic Name: 12-tert-butyl-N,N-dimethyl-7H-indeno[1,2-b]quinolizin-5-ium-2-amine; methanesulfonate Openeye Name: 12-tert-butyl-N,N-dimethyl-7H-indeno[1,2-b]quinolizin-5-ium-2-amine; methanesulfonate CAS Name: 12-tert-butyl-N,N-dimethyl-7H-indeno[1,2-b]quinolizin-5-ium-2-amine; methanesulfonate IUPAC Name: 12-tert-butyl-N,N-dimethyl-7H-indeno[1,2-b]quinolizin-5-ium-2-amine; methanesulfonate Traditional Name: (12-tert-butyl-7H-indeno[1,2-b]quinolizin-5-ium-2-yl)-dimethyl-amine mesylate Formula: C23H28N2O3S MolecularWeight: 412.54502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C(=C[N+]3=C1C=C(C=C3)N(C)C)CC4=CC=CC=C42.CS(=O)(=O)[O-]

Isomeric SMILES

CC(C)(C)C1=C2C(=C[N+]3=C1C=C(C=C3)N(C)C)CC4=CC=CC=C42.CS(=O)(=O)[O-]

InChI

InChI=1S/C22H25N2.CH4O3S/c1-22(2,3)21-19-13-17(23(4)5)10-11-24(19)14-16-12-15-8-6-7-9-18(15)20(16)21;1-5(2,3)4/h6-11,13-14H,12H2,1-5H3;1H3,(H,2,3,4)/q+1;/p-1