N-(2-butyl-1,2,3,4-tetrazol-5-yl)-2-morpholin-4-yl-5-nitro-benzamide

Systemtic Name: N-(2-butyl-1,2,3,4-tetrazol-5-yl)-2-morpholin-4-yl-5-nitro-benzamide Openeye Name: N-(2-butyltetrazol-5-yl)-2-morpholino-5-nitro-benzamide CAS Name: N-(2-butyl-5-tetrazolyl)-2-(4-morpholinyl)-5-nitrobenzamide IUPAC Name: N-(2-butyltetrazol-5-yl)-2-morpholin-4-yl-5-nitrobenzamide Traditional Name: N-(2-butyltetrazol-5-yl)-2-morpholino-5-nitro-benzamide Formula: C16H21N7O4 MolecularWeight: 375.38244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1N=C(N=N1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CCCCN1N=C(N=N1)NC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C16H21N7O4/c1-2-3-6-22-19-16(18-20-22)17-15(24)13-11-12(23(25)26)4-5-14(13)21-7-9-27-10-8-21/h4-5,11H,2-3,6-10H2,1H3,(H,17,19,24)