4-[5-butyl-3-(4-methyl-2-nitro-phenyl)-4,5-dihydro-1,2,3-triazol-4-yl]morpholine

Systemtic Name: 4-[5-butyl-3-(4-methyl-2-nitro-phenyl)-4,5-dihydro-1,2,3-triazol-4-yl]morpholine Openeye Name: 4-[5-butyl-3-(4-methyl-2-nitro-phenyl)-4,5-dihydrotriazol-4-yl]morpholine CAS Name: 4-[5-butyl-3-(4-methyl-2-nitrophenyl)-4,5-dihydrotriazol-4-yl]morpholine IUPAC Name: 4-[5-butyl-3-(4-methyl-2-nitrophenyl)-4,5-dihydrotriazol-4-yl]morpholine Traditional Name: 4-[5-butyl-3-(4-methyl-2-nitro-phenyl)-4,5-dihydrotriazol-4-yl]morpholine Formula: C17H25N5O3 MolecularWeight: 347.4121

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C(N(N=N1)C2=C(C=C(C=C2)C)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CCCCC1C(N(N=N1)C2=C(C=C(C=C2)C)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C17H25N5O3/c1-3-4-5-14-17(20-8-10-25-11-9-20)21(19-18-14)15-7-6-13(2)12-16(15)22(23)24/h6-7,12,14,17H,3-5,8-11H2,1-2H3