3-methoxy-5-nitro-1-[2-[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethoxy]ethyl]indazole

Systemtic Name: 3-methoxy-5-nitro-1-[2-[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethoxy]ethyl]indazole Openeye Name: 1-[2-[2-[4-[(E)-cinnamyl]piperazin-1-yl]ethoxy]ethyl]-3-methoxy-5-nitro-indazole CAS Name: 3-methoxy-5-nitro-1-[2-[2-[4-[(E)-3-phenylprop-2-enyl]-1-piperazinyl]ethoxy]ethyl]indazole IUPAC Name: 3-methoxy-5-nitro-1-[2-[2-[4-[(E)-3-phenylprop-2-enyl]piperazin-1-yl]ethoxy]ethyl]indazole Traditional Name: 1-[2-[2-[4-[(E)-cinnamyl]piperazino]ethoxy]ethyl]-3-methoxy-5-nitro-indazole Formula: C25H31N5O4 MolecularWeight: 465.54474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C2=C1C=C(C=C2)[N+](=O)[O-])CCOCCN3CCN(CC3)CC=CC4=CC=CC=C4

Isomeric SMILES

COC1=NN(C2=C1C=C(C=C2)[N+](=O)[O-])CCOCCN3CCN(CC3)C/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H31N5O4/c1-33-25-23-20-22(30(31)32)9-10-24(23)29(26-25)17-19-34-18-16-28-14-12-27(13-15-28)11-5-8-21-6-3-2-4-7-21/h2-10,20H,11-19H2,1H3/b8-5+