2-[3-ethanoyl-2-methyl-5-(2-nitrophenyl)pyrrol-1-yl]propanoic acid

Systemtic Name: 2-[3-ethanoyl-2-methyl-5-(2-nitrophenyl)pyrrol-1-yl]propanoic acid Openeye Name: 2-[3-acetyl-2-methyl-5-(2-nitrophenyl)pyrrol-1-yl]propanoic acid CAS Name: 2-[3-acetyl-2-methyl-5-(2-nitrophenyl)-1-pyrrolyl]propanoic acid IUPAC Name: 2-[3-acetyl-2-methyl-5-(2-nitrophenyl)pyrrol-1-yl]propanoic acid Traditional Name: 2-[3-acetyl-2-methyl-5-(2-nitrophenyl)pyrrol-1-yl]propionic acid Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1C(C)C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)C

Isomeric SMILES

CC1=C(C=C(N1C(C)C(=O)O)C2=CC=CC=C2[N+](=O)[O-])C(=O)C

InChI

InChI=1S/C16H16N2O5/c1-9-13(11(3)19)8-15(17(9)10(2)16(20)21)12-6-4-5-7-14(12)18(22)23/h4-8,10H,1-3H3,(H,20,21)