N-[(E)-1-(5-nitro-1,2,3,4-tetrazol-2-yl)propan-2-ylideneamino]octanamide

Systemtic Name: N-[(E)-1-(5-nitro-1,2,3,4-tetrazol-2-yl)propan-2-ylideneamino]octanamide Openeye Name: N-[(E)-[1-methyl-2-(5-nitrotetrazol-2-yl)ethylidene]amino]octanamide CAS Name: N-[(E)-1-(5-nitro-2-tetrazolyl)propan-2-ylideneamino]octanamide IUPAC Name: N-[(E)-1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]octanamide Traditional Name: N-[(E)-[1-methyl-2-(5-nitrotetrazol-2-yl)ethylidene]amino]caprylamide Formula: C12H21N7O3 MolecularWeight: 311.34024

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NN=C(C)CN1N=C(N=N1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCC(=O)N/N=C(\C)/CN1N=C(N=N1)[N+](=O)[O-]

InChI

InChI=1S/C12H21N7O3/c1-3-4-5-6-7-8-11(20)14-13-10(2)9-18-16-12(15-17-18)19(21)22/h3-9H2,1-2H3,(H,14,20)/b13-10+