2-[2,3-dimethyl-4-(4-nitrophenyl)carbonyl-pyrrol-2-yl]ethanoic acid

Systemtic Name: 2-[2,3-dimethyl-4-(4-nitrophenyl)carbonyl-pyrrol-2-yl]ethanoic acid Openeye Name: 2-[2,3-dimethyl-4-(4-nitrobenzoyl)pyrrol-2-yl]acetic acid CAS Name: 2-[2,3-dimethyl-4-[(4-nitrophenyl)-oxomethyl]-2-pyrrolyl]acetic acid IUPAC Name: 2-[2,3-dimethyl-4-(4-nitrobenzoyl)pyrrol-2-yl]acetic acid Traditional Name: 2-[2,3-dimethyl-4-(4-nitrobenzoyl)pyrrol-2-yl]acetic acid Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NC1(C)CC(=O)O)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=NC1(C)CC(=O)O)C(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O5/c1-9-12(8-16-15(9,2)7-13(18)19)14(20)10-3-5-11(6-4-10)17(21)22/h3-6,8H,7H2,1-2H3,(H,18,19)