1-[6-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-2,3-dihydroindole

Systemtic Name: 1-[6-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]-2,3-dihydroindole Openeye Name: 1-[6-(4-ethylpiperazin-1-yl)-5-nitro-pyrimidin-4-yl]indoline CAS Name: 1-[6-(4-ethyl-1-piperazinyl)-5-nitro-4-pyrimidinyl]-2,3-dihydroindole IUPAC Name: 1-[6-(4-ethylpiperazin-1-yl)-5-nitropyrimidin-4-yl]-2,3-dihydroindole Traditional Name: 1-[6-(4-ethylpiperazino)-5-nitro-pyrimidin-4-yl]indoline Formula: C18H22N6O2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

Isomeric SMILES

CCN1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

InChI

InChI=1S/C18H22N6O2/c1-2-21-9-11-22(12-10-21)17-16(24(25)26)18(20-13-19-17)23-8-7-14-5-3-4-6-15(14)23/h3-6,13H,2,7-12H2,1H3