2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-nitro-2,3-dihydroindol-1-yl)ethanone

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-nitro-2,3-dihydroindol-1-yl)ethanone Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-nitroindolin-1-yl)ethanone CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-(5-nitro-2,3-dihydroindol-1-yl)ethanone IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-1-(5-nitro-2,3-dihydroindol-1-yl)ethanone Traditional Name: 1-(5-nitroindolin-1-yl)-2-(4-piperonylpiperazino)ethanone Formula: C22H24N4O5 MolecularWeight: 424.44976

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=C1C=C(C=C2)[N+](=O)[O-])C(=O)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CN(C2=C1C=C(C=C2)[N+](=O)[O-])C(=O)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H24N4O5/c27-22(25-6-5-17-12-18(26(28)29)2-3-19(17)25)14-24-9-7-23(8-10-24)13-16-1-4-20-21(11-16)31-15-30-20/h1-4,11-12H,5-10,13-15H2