5-methyl-4-nitro-1-propyl-pyrrole-2-carboxylic acid

Systemtic Name: 5-methyl-4-nitro-1-propyl-pyrrole-2-carboxylic acid Openeye Name: 5-methyl-4-nitro-1-propyl-pyrrole-2-carboxylic acid CAS Name: 5-methyl-4-nitro-1-propyl-2-pyrrolecarboxylic acid IUPAC Name: 5-methyl-4-nitro-1-propylpyrrole-2-carboxylic acid Traditional Name: 5-methyl-4-nitro-1-propyl-pyrrole-2-carboxylic acid Formula: C9H12N2O4 MolecularWeight: 212.20258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H12N2O4/c1-3-4-10-6(2)7(11(14)15)5-8(10)9(12)13/h5H,3-4H2,1-2H3,(H,12,13)