N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-4-methoxy-3-nitro-benzamide Formula: C18H17N5O4 MolecularWeight: 367.35868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CCN1C=NN=C1C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O4/c1-3-22-11-19-21-17(22)12-5-4-6-14(9-12)20-18(24)13-7-8-16(27-2)15(10-13)23(25)26/h4-11H,3H2,1-2H3,(H,20,24)