propyl 1-methyl-5-nitro-pyrrole-2-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(N1C)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=CC=C(N1C)[N+](=O)[O-]

InChI

InChI=1S/C9H12N2O4/c1-3-6-15-9(12)7-4-5-8(10(7)2)11(13)14/h4-5H,3,6H2,1-2H3