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

Systemtic Name: 3-bromanyl-N-[(E)-1-(5-nitro-1,2,3,4-tetrazol-2-yl)propan-2-ylideneamino]benzamide Openeye Name: 3-bromo-N-[(E)-[1-methyl-2-(5-nitrotetrazol-2-yl)ethylidene]amino]benzamide CAS Name: 3-bromo-N-[(E)-1-(5-nitro-2-tetrazolyl)propan-2-ylideneamino]benzamide IUPAC Name: 3-bromo-N-[(E)-1-(5-nitrotetrazol-2-yl)propan-2-ylideneamino]benzamide Traditional Name: 3-bromo-N-[(E)-[1-methyl-2-(5-nitrotetrazol-2-yl)ethylidene]amino]benzamide Formula: C11H10BrN7O3 MolecularWeight: 368.1462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC(=CC=C1)Br)CN2N=C(N=N2)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C11H10BrN7O3/c1-7(6-18-16-11(15-17-18)19(21)22)13-14-10(20)8-3-2-4-9(12)5-8/h2-5H,6H2,1H3,(H,14,20)/b13-7+