1-(6-bromanylhexyl)-5-nitro-3-phenylmethoxy-indazole

Systemtic Name: 1-(6-bromanylhexyl)-5-nitro-3-phenylmethoxy-indazole Openeye Name: 3-benzyloxy-1-(6-bromohexyl)-5-nitro-indazole CAS Name: 1-(6-bromohexyl)-5-nitro-3-phenylmethoxyindazole IUPAC Name: 1-(6-bromohexyl)-5-nitro-3-phenylmethoxyindazole Traditional Name: 3-benzoxy-1-(6-bromohexyl)-5-nitro-indazole Formula: C20H22BrN3O3 MolecularWeight: 432.31098

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=NN(C3=C2C=C(C=C3)[N+](=O)[O-])CCCCCCBr

Isomeric SMILES

C1=CC=C(C=C1)COC2=NN(C3=C2C=C(C=C3)[N+](=O)[O-])CCCCCCBr

InChI

InChI=1S/C20H22BrN3O3/c21-12-6-1-2-7-13-23-19-11-10-17(24(25)26)14-18(19)20(22-23)27-15-16-8-4-3-5-9-16/h3-5,8-11,14H,1-2,6-7,12-13,15H2