2,5-dimethyl-4-(4-nitrophenyl)-1H-pyrrole-3-carboxylic acid

Systemtic Name: 2,5-dimethyl-4-(4-nitrophenyl)-1H-pyrrole-3-carboxylic acid Openeye Name: 2,5-dimethyl-4-(4-nitrophenyl)-1H-pyrrole-3-carboxylic acid CAS Name: 2,5-dimethyl-4-(4-nitrophenyl)-1H-pyrrole-3-carboxylic acid IUPAC Name: 2,5-dimethyl-4-(4-nitrophenyl)-1H-pyrrole-3-carboxylic acid Traditional Name: 2,5-dimethyl-4-(4-nitrophenyl)-1H-pyrrole-3-carboxylic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C)C(=O)O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=C(N1)C)C(=O)O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O4/c1-7-11(12(13(16)17)8(2)14-7)9-3-5-10(6-4-9)15(18)19/h3-6,14H,1-2H3,(H,16,17)