3-(4-methoxy-2-nitro-phenyl)-5,5-dimethyl-N,N-bis(phenylmethyl)-4H-1,2,3-triazol-4-amine

Systemtic Name: 3-(4-methoxy-2-nitro-phenyl)-5,5-dimethyl-N,N-bis(phenylmethyl)-4H-1,2,3-triazol-4-amine Openeye Name: N,N-dibenzyl-3-(4-methoxy-2-nitro-phenyl)-5,5-dimethyl-4H-triazol-4-amine CAS Name: 3-(4-methoxy-2-nitrophenyl)-5,5-dimethyl-N,N-bis(phenylmethyl)-4H-triazol-4-amine IUPAC Name: N,N-dibenzyl-3-(4-methoxy-2-nitrophenyl)-5,5-dimethyl-4H-triazol-4-amine Traditional Name: dibenzyl-[3-(4-methoxy-2-nitro-phenyl)-5,5-dimethyl-4H-triazol-4-yl]amine Formula: C25H27N5O3 MolecularWeight: 445.51358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(N=N1)C2=C(C=C(C=C2)OC)[N+](=O)[O-])N(CC3=CC=CC=C3)CC4=CC=CC=C4)C

Isomeric SMILES

CC1(C(N(N=N1)C2=C(C=C(C=C2)OC)[N+](=O)[O-])N(CC3=CC=CC=C3)CC4=CC=CC=C4)C

InChI

InChI=1S/C25H27N5O3/c1-25(2)24(29(27-26-25)22-15-14-21(33-3)16-23(22)30(31)32)28(17-19-10-6-4-7-11-19)18-20-12-8-5-9-13-20/h4-16,24H,17-18H2,1-3H3