4-nitro-1-propan-2-yl-pyrrole-2-carboxylic acid

Systemtic Name: 4-nitro-1-propan-2-yl-pyrrole-2-carboxylic acid Openeye Name: 1-isopropyl-4-nitro-pyrrole-2-carboxylic acid CAS Name: 4-nitro-1-propan-2-yl-2-pyrrolecarboxylic acid IUPAC Name: 4-nitro-1-propan-2-ylpyrrole-2-carboxylic acid Traditional Name: 1-isopropyl-4-nitro-pyrrole-2-carboxylic acid Formula: C8H10N2O4 MolecularWeight: 198.176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=C(C=C1C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C=C(C=C1C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C8H10N2O4/c1-5(2)9-4-6(10(13)14)3-7(9)8(11)12/h3-5H,1-2H3,(H,11,12)