2-[3-(3-nitrophenyl)-1H-1,2,4-triazol-5-yl]aniline

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NC(=NN2)C3=CC(=CC=C3)[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C(C(=C1)C2=NC(=NN2)C3=CC(=CC=C3)[N+](=O)[O-])N

InChI

InChI=1S/C14H11N5O2/c15-12-7-2-1-6-11(12)14-16-13(17-18-14)9-4-3-5-10(8-9)19(20)21/h1-8H,15H2,(H,16,17,18)