4-nitro-N-(1-oxidanylbutan-2-yl)-1-propyl-pyrrole-2-carboxamide

Systemtic Name: 4-nitro-N-(1-oxidanylbutan-2-yl)-1-propyl-pyrrole-2-carboxamide Openeye Name: N-[1-(hydroxymethyl)propyl]-4-nitro-1-propyl-pyrrole-2-carboxamide CAS Name: N-(1-hydroxybutan-2-yl)-4-nitro-1-propyl-2-pyrrolecarboxamide IUPAC Name: N-(1-hydroxybutan-2-yl)-4-nitro-1-propylpyrrole-2-carboxamide Traditional Name: N-(1-methylolpropyl)-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(CC)CO)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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