3-nitro-4-(1,2,4-triazol-1-yl)-N-(3,4,5-trimethoxyphenyl)benzamide

Systemtic Name: 3-nitro-4-(1,2,4-triazol-1-yl)-N-(3,4,5-trimethoxyphenyl)benzamide Openeye Name: 3-nitro-4-(1,2,4-triazol-1-yl)-N-(3,4,5-trimethoxyphenyl)benzamide CAS Name: 3-nitro-4-(1,2,4-triazol-1-yl)-N-(3,4,5-trimethoxyphenyl)benzamide IUPAC Name: 3-nitro-4-(1,2,4-triazol-1-yl)-N-(3,4,5-trimethoxyphenyl)benzamide Traditional Name: 3-nitro-4-(1,2,4-triazol-1-yl)-N-(3,4,5-trimethoxyphenyl)benzamide Formula: C18H17N5O6 MolecularWeight: 399.35748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N5O6/c1-27-15-7-12(8-16(28-2)17(15)29-3)21-18(24)11-4-5-13(14(6-11)23(25)26)22-10-19-9-20-22/h4-10H,1-3H3,(H,21,24)