5-acetamido-2-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]benzoic acid

Systemtic Name: 5-acetamido-2-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]benzoic acid Openeye Name: 5-acetamido-2-(3-methyl-2,5-dioxo-pyrrol-1-yl)benzoic acid CAS Name: 5-acetamido-2-(3-methyl-2,5-dioxo-1-pyrrolyl)benzoic acid IUPAC Name: 5-acetamido-2-(3-methyl-2,5-dioxopyrrol-1-yl)benzoic acid Traditional Name: 5-acetamido-2-citraconimido-benzoic acid Formula: C14H12N2O5 MolecularWeight: 288.25548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)C2=C(C=C(C=C2)NC(=O)C)C(=O)O

Isomeric SMILES

CC1=CC(=O)N(C1=O)C2=C(C=C(C=C2)NC(=O)C)C(=O)O

InChI

InChI=1S/C14H12N2O5/c1-7-5-12(18)16(13(7)19)11-4-3-9(15-8(2)17)6-10(11)14(20)21/h3-6H,1-2H3,(H,15,17)(H,20,21)