5-bromanyl-8-[6-(2,3-dihydroindol-1-yl)-5-nitro-pyrimidin-4-yl]oxy-quinoline

Systemtic Name: 5-bromanyl-8-[6-(2,3-dihydroindol-1-yl)-5-nitro-pyrimidin-4-yl]oxy-quinoline Openeye Name: 5-bromo-8-(6-indolin-1-yl-5-nitro-pyrimidin-4-yl)oxy-quinoline CAS Name: 5-bromo-8-[[6-(2,3-dihydroindol-1-yl)-5-nitro-4-pyrimidinyl]oxy]quinoline IUPAC Name: 5-bromo-8-[6-(2,3-dihydroindol-1-yl)-5-nitropyrimidin-4-yl]oxyquinoline Traditional Name: 5-bromo-8-(6-indolin-1-yl-5-nitro-pyrimidin-4-yl)oxy-quinoline Formula: C21H14BrN5O3 MolecularWeight: 464.27156

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C3=C(C(=NC=N3)OC4=C5C(=C(C=C4)Br)C=CC=N5)[N+](=O)[O-]

Isomeric SMILES

C1CN(C2=CC=CC=C21)C3=C(C(=NC=N3)OC4=C5C(=C(C=C4)Br)C=CC=N5)[N+](=O)[O-]

InChI

InChI=1S/C21H14BrN5O3/c22-15-7-8-17(18-14(15)5-3-10-23-18)30-21-19(27(28)29)20(24-12-25-21)26-11-9-13-4-1-2-6-16(13)26/h1-8,10,12H,9,11H2