1-methyl-3-nitro-pyrrol-1-ium-1-carboxylic acid

Systemtic Name: 1-methyl-3-nitro-pyrrol-1-ium-1-carboxylic acid Openeye Name: 1-methyl-3-nitro-pyrrol-1-ium-1-carboxylic acid CAS Name: 1-methyl-3-nitro-1-pyrrol-1-iumcarboxylic acid IUPAC Name: 1-methyl-3-nitropyrrol-1-ium-1-carboxylic acid Traditional Name: 1-methyl-3-nitro-pyrrol-1-ium-1-carboxylic acid Formula: C6H7N2O4+ MolecularWeight: 171.13078

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(C=CC(=C1)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C[N+]1(C=CC(=C1)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C6H6N2O4/c1-8(6(9)10)3-2-5(4-8)7(11)12/h2-4H,1H3/p+1