N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-3,4,5-trimethoxy-2-nitro-benzamide

Systemtic Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-3,4,5-trimethoxy-2-nitro-benzamide Openeye Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-3,4,5-trimethoxy-2-nitro-benzamide CAS Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-3,4,5-trimethoxy-2-nitrobenzamide IUPAC Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-3,4,5-trimethoxy-2-nitrobenzamide Traditional Name: N-[3-(4-ethyl-1,2,4-triazol-3-yl)phenyl]-3,4,5-trimethoxy-2-nitro-benzamide Formula: C20H21N5O6 MolecularWeight: 427.41064

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21N5O6/c1-5-24-11-21-23-19(24)12-7-6-8-13(9-12)22-20(26)14-10-15(29-2)17(30-3)18(31-4)16(14)25(27)28/h6-11H,5H2,1-4H3,(H,22,26)