N-(2-ethyl-6-methyl-phenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-(5-methyl-3-nitro-1,2,4-triazol-1-yl)acetamide Formula: C14H17N5O3 MolecularWeight: 303.31648

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CN2C(=NC(=N2)[N+](=O)[O-])C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CN2C(=NC(=N2)[N+](=O)[O-])C)C

InChI

InChI=1S/C14H17N5O3/c1-4-11-7-5-6-9(2)13(11)16-12(20)8-18-10(3)15-14(17-18)19(21)22/h5-7H,4,8H2,1-3H3,(H,16,20)