N-(2-methyl-1-oxidanyl-propan-2-yl)-4-nitro-1-propyl-pyrrole-2-carboxamide

Systemtic Name: N-(2-methyl-1-oxidanyl-propan-2-yl)-4-nitro-1-propyl-pyrrole-2-carboxamide Openeye Name: N-(2-hydroxy-1,1-dimethyl-ethyl)-4-nitro-1-propyl-pyrrole-2-carboxamide CAS Name: N-(1-hydroxy-2-methylpropan-2-yl)-4-nitro-1-propyl-2-pyrrolecarboxamide IUPAC Name: N-(1-hydroxy-2-methylpropan-2-yl)-4-nitro-1-propylpyrrole-2-carboxamide Traditional Name: N-(2-hydroxy-1,1-dimethyl-ethyl)-4-nitro-1-propyl-pyrrole-2-carboxamide Formula: C12H19N3O4 MolecularWeight: 269.29696

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C=C1C(=O)NC(C)(C)CO)[N+](=O)[O-]

Isomeric SMILES

CCCN1C=C(C=C1C(=O)NC(C)(C)CO)[N+](=O)[O-]

InChI

InChI=1S/C12H19N3O4/c1-4-5-14-7-9(15(18)19)6-10(14)11(17)13-12(2,3)8-16/h6-7,16H,4-5,8H2,1-3H3,(H,13,17)