1-[4-[3-(4-nitrophenyl)-1,2,3-triazol-4-yl]phenyl]-3-phenyl-urea

Systemtic Name: 1-[4-[3-(4-nitrophenyl)-1,2,3-triazol-4-yl]phenyl]-3-phenyl-urea Openeye Name: 1-[4-[3-(4-nitrophenyl)triazol-4-yl]phenyl]-3-phenyl-urea CAS Name: 1-[4-[3-(4-nitrophenyl)-4-triazolyl]phenyl]-3-phenylurea IUPAC Name: 1-[4-[3-(4-nitrophenyl)triazol-4-yl]phenyl]-3-phenylurea Traditional Name: 1-[4-[3-(4-nitrophenyl)triazol-4-yl]phenyl]-3-phenyl-urea Formula: C21H16N6O3 MolecularWeight: 400.39014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C3=CN=NN3C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)C3=CN=NN3C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H16N6O3/c28-21(23-16-4-2-1-3-5-16)24-17-8-6-15(7-9-17)20-14-22-25-26(20)18-10-12-19(13-11-18)27(29)30/h1-14H,(H2,23,24,28)