N-(3-hydroxyphenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide

Systemtic Name: N-(3-hydroxyphenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide Openeye Name: N-(3-hydroxyphenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide CAS Name: N-(3-hydroxyphenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide IUPAC Name: N-(3-hydroxyphenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butanamide Traditional Name: N-(3-hydroxyphenyl)-4-(3-nitro-1,2,4-triazol-1-yl)butyramide Formula: C12H13N5O4 MolecularWeight: 291.26272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)O)NC(=O)CCCN2C=NC(=N2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)O)NC(=O)CCCN2C=NC(=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O4/c18-10-4-1-3-9(7-10)14-11(19)5-2-6-16-8-13-12(15-16)17(20)21/h1,3-4,7-8,18H,2,5-6H2,(H,14,19)