3-nitro-4-propyl-1H-pyrrole-2-carboxylic acid

Systemtic Name: 3-nitro-4-propyl-1H-pyrrole-2-carboxylic acid Openeye Name: 3-nitro-4-propyl-1H-pyrrole-2-carboxylic acid CAS Name: 3-nitro-4-propyl-1H-pyrrole-2-carboxylic acid IUPAC Name: 3-nitro-4-propyl-1H-pyrrole-2-carboxylic acid Traditional Name: 3-nitro-4-propyl-1H-pyrrole-2-carboxylic acid Formula: C8H10N2O4 MolecularWeight: 198.176

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CNC(=C1[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCCC1=CNC(=C1[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C8H10N2O4/c1-2-3-5-4-9-6(8(11)12)7(5)10(13)14/h4,9H,2-3H2,1H3,(H,11,12)