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

Systemtic Name: N-cyclooctyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-cyclooctyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-cyclooctyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-cyclooctyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-cyclooctyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C17H21N5O3 MolecularWeight: 343.38034

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CCC1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O3/c23-17(20-14-6-4-2-1-3-5-7-14)13-8-9-15(16(10-13)22(24)25)21-12-18-11-19-21/h8-12,14H,1-7H2,(H,20,23)