4-[3-(3-nitro-4-propan-2-yloxy-phenyl)-1H-1,2,4-triazol-5-yl]pyridine

Systemtic Name: 4-[3-(3-nitro-4-propan-2-yloxy-phenyl)-1H-1,2,4-triazol-5-yl]pyridine Openeye Name: 4-[3-(4-isopropoxy-3-nitro-phenyl)-1H-1,2,4-triazol-5-yl]pyridine CAS Name: 4-[3-(3-nitro-4-propan-2-yloxyphenyl)-1H-1,2,4-triazol-5-yl]pyridine IUPAC Name: 4-[3-(3-nitro-4-propan-2-yloxyphenyl)-1H-1,2,4-triazol-5-yl]pyridine Traditional Name: 4-[3-(4-isopropoxy-3-nitro-phenyl)-1H-1,2,4-triazol-5-yl]pyridine Formula: C16H15N5O3 MolecularWeight: 325.322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1)C2=NNC(=N2)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1)C2=NNC(=N2)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H15N5O3/c1-10(2)24-14-4-3-12(9-13(14)21(22)23)16-18-15(19-20-16)11-5-7-17-8-6-11/h3-10H,1-2H3,(H,18,19,20)