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

Systemtic Name: 4-[3-(3-chlorophenyl)-1H-1,2,4-triazol-5-yl]aniline Openeye Name: 4-[3-(3-chlorophenyl)-1H-1,2,4-triazol-5-yl]aniline CAS Name: 4-[3-(3-chlorophenyl)-1H-1,2,4-triazol-5-yl]aniline IUPAC Name: 4-[3-(3-chlorophenyl)-1H-1,2,4-triazol-5-yl]aniline Traditional Name: [4-[3-(3-chlorophenyl)-1H-1,2,4-triazol-5-yl]phenyl]amine Formula: C14H11ClN4 MolecularWeight: 270.71694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C2=NNC(=N2)C3=CC=C(C=C3)N

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C2=NNC(=N2)C3=CC=C(C=C3)N

InChI

InChI=1S/C14H11ClN4/c15-11-3-1-2-10(8-11)14-17-13(18-19-14)9-4-6-12(16)7-5-9/h1-8H,16H2,(H,17,18,19)