5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)-1,2,3-triazol-4-amine

Systemtic Name: 5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)-1,2,3-triazol-4-amine Openeye Name: 3-(3-nitrophenyl)-5-[3-(p-tolyl)-1H-pyrazol-5-yl]triazol-4-amine CAS Name: 5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)-4-triazolamine IUPAC Name: 5-[3-(4-methylphenyl)-1H-pyrazol-5-yl]-3-(3-nitrophenyl)triazol-4-amine Traditional Name: [3-(3-nitrophenyl)-5-[3-(p-tolyl)-1H-pyrazol-5-yl]triazol-4-yl]amine Formula: C18H15N7O2 MolecularWeight: 361.3574

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NNC(=C2)C3=C(N(N=N3)C4=CC(=CC=C4)[N+](=O)[O-])N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NNC(=C2)C3=C(N(N=N3)C4=CC(=CC=C4)[N+](=O)[O-])N

InChI

InChI=1S/C18H15N7O2/c1-11-5-7-12(8-6-11)15-10-16(21-20-15)17-18(19)24(23-22-17)13-3-2-4-14(9-13)25(26)27/h2-10H,19H2,1H3,(H,20,21)