[5-(4-ethylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone

Systemtic Name: [5-(4-ethylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Openeye Name: [5-(4-ethylphenyl)-3-isopropoxy-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone CAS Name: [5-(4-ethylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone IUPAC Name: [5-(4-ethylphenyl)-3-propan-2-yloxy-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Traditional Name: [5-(4-ethylphenyl)-3-isopropoxy-1,2,4-triazol-1-yl]-(4-nitrophenyl)methanone Formula: C20H20N4O4 MolecularWeight: 380.3972

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NC(=NN2C(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NC(=NN2C(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC(C)C

InChI

InChI=1S/C20H20N4O4/c1-4-14-5-7-15(8-6-14)18-21-20(28-13(2)3)22-23(18)19(25)16-9-11-17(12-10-16)24(26)27/h5-13H,4H2,1-3H3