2-(7-nitro-1,1-dipropyl-indazol-1-ium-4-yl)ethanamine

Systemtic Name: 2-(7-nitro-1,1-dipropyl-indazol-1-ium-4-yl)ethanamine Openeye Name: 2-(7-nitro-1,1-dipropyl-indazol-1-ium-4-yl)ethanamine CAS Name: 2-(7-nitro-1,1-dipropyl-4-indazol-1-iumyl)ethanamine IUPAC Name: 2-(7-nitro-1,1-dipropylindazol-1-ium-4-yl)ethanamine Traditional Name: 2-(7-nitro-1,1-dipropyl-indazol-1-ium-4-yl)ethylamine Formula: C15H23N4O2+ MolecularWeight: 291.36872

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1(C2=C(C=CC(=C2C=N1)CCN)[N+](=O)[O-])CCC

Isomeric SMILES

CCC[N+]1(C2=C(C=CC(=C2C=N1)CCN)[N+](=O)[O-])CCC

InChI

InChI=1S/C15H23N4O2/c1-3-9-19(10-4-2)15-13(11-17-19)12(7-8-16)5-6-14(15)18(20)21/h5-6,11H,3-4,7-10,16H2,1-2H3/q+1