4-[6-[4-chloranyl-2-(1H-pyrazol-5-yl)phenoxy]-5-nitro-pyrimidin-4-yl]morpholine

Systemtic Name: 4-[6-[4-chloranyl-2-(1H-pyrazol-5-yl)phenoxy]-5-nitro-pyrimidin-4-yl]morpholine Openeye Name: 4-[6-[4-chloro-2-(1H-pyrazol-5-yl)phenoxy]-5-nitro-pyrimidin-4-yl]morpholine CAS Name: 4-[6-[4-chloro-2-(1H-pyrazol-5-yl)phenoxy]-5-nitro-4-pyrimidinyl]morpholine IUPAC Name: 4-[6-[4-chloro-2-(1H-pyrazol-5-yl)phenoxy]-5-nitropyrimidin-4-yl]morpholine Traditional Name: 4-[6-[4-chloro-2-(1H-pyrazol-5-yl)phenoxy]-5-nitro-pyrimidin-4-yl]morpholine Formula: C17H15ClN6O4 MolecularWeight: 402.7918

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C(=NC=N2)OC3=C(C=C(C=C3)Cl)C4=CC=NN4)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C(=NC=N2)OC3=C(C=C(C=C3)Cl)C4=CC=NN4)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClN6O4/c18-11-1-2-14(12(9-11)13-3-4-21-22-13)28-17-15(24(25)26)16(19-10-20-17)23-5-7-27-8-6-23/h1-4,9-10H,5-8H2,(H,21,22)