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

Systemtic Name: [(E)-1-(5-nitro-1,2,3,4-tetrazol-2-yl)propan-2-ylideneamino] 2-fluoranylbenzoate Openeye Name: [(E)-[1-methyl-2-(5-nitrotetrazol-2-yl)ethylidene]amino] 2-fluorobenzoate CAS Name: 2-fluorobenzoic acid [(E)-1-(5-nitro-2-tetrazolyl)propan-2-ylideneamino] ester IUPAC Name: [(E)-1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino] 2-fluorobenzoate Traditional Name: 2-fluorobenzoic acid [(E)-[1-methyl-2-(5-nitrotetrazol-2-yl)ethylidene]amino] ester Formula: C11H9FN6O4 MolecularWeight: 308.225363

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOC(=O)C1=CC=CC=C1F)CN2N=C(N=N2)[N+](=O)[O-]

Isomeric SMILES

C/C(=N\OC(=O)C1=CC=CC=C1F)/CN2N=C(N=N2)[N+](=O)[O-]

InChI

InChI=1S/C11H9FN6O4/c1-7(6-17-14-11(13-16-17)18(20)21)15-22-10(19)8-4-2-3-5-9(8)12/h2-5H,6H2,1H3/b15-7+