4-methyl-5-[3-(2-nitropropan-2-yl)cyclohexyl]oxy-1H-indazole

Systemtic Name: 4-methyl-5-[3-(2-nitropropan-2-yl)cyclohexyl]oxy-1H-indazole Openeye Name: 4-methyl-5-[3-(1-methyl-1-nitro-ethyl)cyclohexoxy]-1H-indazole CAS Name: 4-methyl-5-[3-(2-nitropropan-2-yl)cyclohexyl]oxy-1H-indazole IUPAC Name: 4-methyl-5-[3-(2-nitropropan-2-yl)cyclohexyl]oxy-1H-indazole Traditional Name: 4-methyl-5-[3-(1-methyl-1-nitro-ethyl)cyclohexoxy]-1H-indazole Formula: C17H23N3O3 MolecularWeight: 317.38282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C=NN2)OC3CCCC(C3)C(C)(C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC2=C1C=NN2)OC3CCCC(C3)C(C)(C)[N+](=O)[O-]

InChI

InChI=1S/C17H23N3O3/c1-11-14-10-18-19-15(14)7-8-16(11)23-13-6-4-5-12(9-13)17(2,3)20(21)22/h7-8,10,12-13H,4-6,9H2,1-3H3,(H,18,19)