N-(3,4-dimethoxyphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide

Systemtic Name: N-(3,4-dimethoxyphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)ethanamide Openeye Name: N-(3,4-dimethoxyphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide CAS Name: N-(3,4-dimethoxyphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide IUPAC Name: N-(3,4-dimethoxyphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide Traditional Name: N-(3,4-dimethoxyphenyl)-2-(3-nitro-1,2,4-triazol-1-yl)acetamide Formula: C12H13N5O5 MolecularWeight: 307.26212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2C=NC(=N2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2C=NC(=N2)[N+](=O)[O-])OC

InChI

InChI=1S/C12H13N5O5/c1-21-9-4-3-8(5-10(9)22-2)14-11(18)6-16-7-13-12(15-16)17(19)20/h3-5,7H,6H2,1-2H3,(H,14,18)