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

Systemtic Name: N-(2-methyl-1,2,3,4-tetrazol-5-yl)-4-morpholin-4-yl-3-nitro-benzamide Openeye Name: N-(2-methyltetrazol-5-yl)-4-morpholino-3-nitro-benzamide CAS Name: N-(2-methyl-5-tetrazolyl)-4-(4-morpholinyl)-3-nitrobenzamide IUPAC Name: N-(2-methyltetrazol-5-yl)-4-morpholin-4-yl-3-nitrobenzamide Traditional Name: N-(2-methyltetrazol-5-yl)-4-morpholino-3-nitro-benzamide Formula: C13H15N7O4 MolecularWeight: 333.3027

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Descriptors Computed from Structure

Canonical SMILES:

CN1N=C(N=N1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

Isomeric SMILES

CN1N=C(N=N1)NC(=O)C2=CC(=C(C=C2)N3CCOCC3)[N+](=O)[O-]

InChI

InChI=1S/C13H15N7O4/c1-18-16-13(15-17-18)14-12(21)9-2-3-10(11(8-9)20(22)23)19-4-6-24-7-5-19/h2-3,8H,4-7H2,1H3,(H,14,16,21)