N-(2-ethenyl-1,2,3,4-tetrazol-5-yl)-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-(2-ethenyl-1,2,3,4-tetrazol-5-yl)-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: 3-nitro-4-(1-piperidyl)-N-(2-vinyltetrazol-5-yl)benzamide CAS Name: N-(2-ethenyl-5-tetrazolyl)-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-(2-ethenyltetrazol-5-yl)-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: 3-nitro-4-piperidino-N-(2-vinyltetrazol-5-yl)benzamide Formula: C15H17N7O3 MolecularWeight: 343.34058

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Descriptors Computed from Structure

Canonical SMILES:

C=CN1N=C(N=N1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

C=CN1N=C(N=N1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N7O3/c1-2-21-18-15(17-19-21)16-14(23)11-6-7-12(13(10-11)22(24)25)20-8-4-3-5-9-20/h2,6-7,10H,1,3-5,8-9H2,(H,16,18,23)