methyl 4-[6-(2,3-dihydroindol-1-yl)-5-nitro-pyrimidin-4-yl]oxybenzoate

Systemtic Name: methyl 4-[6-(2,3-dihydroindol-1-yl)-5-nitro-pyrimidin-4-yl]oxybenzoate Openeye Name: methyl 4-(6-indolin-1-yl-5-nitro-pyrimidin-4-yl)oxybenzoate CAS Name: 4-[[6-(2,3-dihydroindol-1-yl)-5-nitro-4-pyrimidinyl]oxy]benzoic acid methyl ester IUPAC Name: methyl 4-[6-(2,3-dihydroindol-1-yl)-5-nitropyrimidin-4-yl]oxybenzoate Traditional Name: 4-(6-indolin-1-yl-5-nitro-pyrimidin-4-yl)oxybenzoic acid methyl ester Formula: C20H16N4O5 MolecularWeight: 392.36484

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

InChI

InChI=1S/C20H16N4O5/c1-28-20(25)14-6-8-15(9-7-14)29-19-17(24(26)27)18(21-12-22-19)23-11-10-13-4-2-3-5-16(13)23/h2-9,12H,10-11H2,1H3