2-[1-methyl-5-(4-nitrophenyl)carbonyl-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[1-methyl-5-(4-nitrophenyl)carbonyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[1-methyl-5-(4-nitrobenzoyl)pyrrol-2-yl]acetic acid CAS Name: 2-[1-methyl-5-[(4-nitrophenyl)-oxomethyl]-2-pyrrolyl]acetic acid IUPAC Name: 2-[1-methyl-5-(4-nitrobenzoyl)pyrrol-2-yl]acetic acid Traditional Name: 2-[1-methyl-5-(4-nitrobenzoyl)pyrrol-2-yl]acetic acid Formula: C14H12N2O5 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC(=O)O

Isomeric SMILES

CN1C(=CC=C1C(=O)C2=CC=C(C=C2)[N+](=O)[O-])CC(=O)O

InChI

InChI=1S/C14H12N2O5/c1-15-11(8-13(17)18)6-7-12(15)14(19)9-2-4-10(5-3-9)16(20)21/h2-7H,8H2,1H3,(H,17,18)