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

Systemtic Name: 4-[3-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazol-5-yl]pyridine Openeye Name: 4-[3-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazol-5-yl]pyridine CAS Name: 4-[3-(3-methyl-4-nitrophenyl)-1H-1,2,4-triazol-5-yl]pyridine IUPAC Name: 4-[3-(3-methyl-4-nitrophenyl)-1H-1,2,4-triazol-5-yl]pyridine Traditional Name: 4-[3-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazol-5-yl]pyridine Formula: C14H11N5O2 MolecularWeight: 281.26944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C2=NNC(=N2)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C2=NNC(=N2)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O2/c1-9-8-11(2-3-12(9)19(20)21)14-16-13(17-18-14)10-4-6-15-7-5-10/h2-8H,1H3,(H,16,17,18)