3-(4-nitrophenyl)-3-pyrrol-1-yl-propanoic acid

Systemtic Name: 3-(4-nitrophenyl)-3-pyrrol-1-yl-propanoic acid Openeye Name: 3-(4-nitrophenyl)-3-pyrrol-1-yl-propanoic acid CAS Name: 3-(4-nitrophenyl)-3-(1-pyrrolyl)propanoic acid IUPAC Name: 3-(4-nitrophenyl)-3-pyrrol-1-ylpropanoic acid Traditional Name: 3-(4-nitrophenyl)-3-pyrrol-1-yl-propionic acid Formula: C13H12N2O4 MolecularWeight: 260.24538

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C(CC(=O)O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CN(C=C1)C(CC(=O)O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H12N2O4/c16-13(17)9-12(14-7-1-2-8-14)10-3-5-11(6-4-10)15(18)19/h1-8,12H,9H2,(H,16,17)