3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-5-nitro-1H-indole

Systemtic Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-5-nitro-1H-indole Openeye Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-5-nitro-1H-indole CAS Name: 3-[3-[4-(5-methoxy-4-pyrimidinyl)-1-piperazinyl]propyl]-5-nitro-1H-indole IUPAC Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-5-nitro-1H-indole Traditional Name: 3-[3-[4-(5-methoxypyrimidin-4-yl)piperazino]propyl]-5-nitro-1H-indole Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=CN=C1N2CCN(CC2)CCCC3=CNC4=C3C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

COC1=CN=CN=C1N2CCN(CC2)CCCC3=CNC4=C3C=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N6O3/c1-29-19-13-21-14-23-20(19)25-9-7-24(8-10-25)6-2-3-15-12-22-18-5-4-16(26(27)28)11-17(15)18/h4-5,11-14,22H,2-3,6-10H2,1H3