ethyl 4-[6-(2,3-dihydroindol-1-yl)-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[6-(2,3-dihydroindol-1-yl)-5-nitro-pyrimidin-4-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-(6-indolin-1-yl-5-nitro-pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-[6-(2,3-dihydroindol-1-yl)-5-nitro-4-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[6-(2,3-dihydroindol-1-yl)-5-nitropyrimidin-4-yl]piperazine-1-carboxylate Traditional Name: 4-(6-indolin-1-yl-5-nitro-pyrimidin-4-yl)piperazine-1-carboxylic acid ethyl ester Formula: C19H22N6O4 MolecularWeight: 398.41578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

InChI

InChI=1S/C19H22N6O4/c1-2-29-19(26)23-11-9-22(10-12-23)17-16(25(27)28)18(21-13-20-17)24-8-7-14-5-3-4-6-15(14)24/h3-6,13H,2,7-12H2,1H3