2,1,3-benzoxadiazol-5-yl-[2-(4-methoxy-5-nitro-thiophen-3-yl)carbonylpyrazolidin-1-yl]methanone

Systemtic Name: 2,1,3-benzoxadiazol-5-yl-[2-(4-methoxy-5-nitro-thiophen-3-yl)carbonylpyrazolidin-1-yl]methanone Openeye Name: 2,1,3-benzoxadiazol-5-yl-[2-(4-methoxy-5-nitro-thiophene-3-carbonyl)pyrazolidin-1-yl]methanone CAS Name: 2,1,3-benzoxadiazol-5-yl-[2-[(4-methoxy-5-nitro-3-thiophenyl)-oxomethyl]-1-pyrazolidinyl]methanone IUPAC Name: 2,1,3-benzoxadiazol-5-yl-[2-(4-methoxy-5-nitrothiophene-3-carbonyl)pyrazolidin-1-yl]methanone Traditional Name: benzofurazan-5-yl-[2-(4-methoxy-5-nitro-thiophene-3-carbonyl)pyrazolidin-1-yl]methanone Formula: C16H13N5O6S MolecularWeight: 403.36932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(SC=C1C(=O)N2CCCN2C(=O)C3=CC4=NON=C4C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(SC=C1C(=O)N2CCCN2C(=O)C3=CC4=NON=C4C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H13N5O6S/c1-26-13-10(8-28-16(13)21(24)25)15(23)20-6-2-5-19(20)14(22)9-3-4-11-12(7-9)18-27-17-11/h3-4,7-8H,2,5-6H2,1H3