1-tert-butyl-1-ethyl-5-nitro-indol-1-ium

Systemtic Name: 1-tert-butyl-1-ethyl-5-nitro-indol-1-ium Openeye Name: 1-tert-butyl-1-ethyl-5-nitro-indol-1-ium CAS Name: 1-tert-butyl-1-ethyl-5-nitroindol-1-ium IUPAC Name: 1-tert-butyl-1-ethyl-5-nitroindol-1-ium Traditional Name: 1-tert-butyl-1-ethyl-5-nitro-indol-1-ium Formula: C14H19N2O2+ MolecularWeight: 247.31286

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1(C=CC2=C1C=CC(=C2)[N+](=O)[O-])C(C)(C)C

Isomeric SMILES

CC[N+]1(C=CC2=C1C=CC(=C2)[N+](=O)[O-])C(C)(C)C

InChI

InChI=1S/C14H19N2O2/c1-5-16(14(2,3)4)9-8-11-10-12(15(17)18)6-7-13(11)16/h6-10H,5H2,1-4H3/q+1