3-(1H-indol-3-yl)-1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propan-1-one

Systemtic Name: 3-(1H-indol-3-yl)-1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propan-1-one Openeye Name: 3-(1H-indol-3-yl)-1-[4-(6-nitro-3-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-(1H-indol-3-yl)-1-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(1H-indol-3-yl)-1-[4-(6-nitropyridin-3-yl)piperazin-1-yl]propan-1-one Traditional Name: 3-(1H-indol-3-yl)-1-[4-(6-nitro-3-pyridyl)piperazino]propan-1-one Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)CCC3=CNC4=CC=CC=C43

Isomeric SMILES

C1CN(CCN1C2=CN=C(C=C2)[N+](=O)[O-])C(=O)CCC3=CNC4=CC=CC=C43

InChI

InChI=1S/C20H21N5O3/c26-20(8-5-15-13-21-18-4-2-1-3-17(15)18)24-11-9-23(10-12-24)16-6-7-19(22-14-16)25(27)28/h1-4,6-7,13-14,21H,5,8-12H2