4-[2-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]ethyl]benzoic acid

Systemtic Name: 4-[2-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]ethyl]benzoic acid Openeye Name: 4-[2-(3-methyl-2,5-dioxo-pyrrol-1-yl)ethyl]benzoic acid CAS Name: 4-[2-(3-methyl-2,5-dioxo-1-pyrrolyl)ethyl]benzoic acid IUPAC Name: 4-[2-(3-methyl-2,5-dioxopyrrol-1-yl)ethyl]benzoic acid Traditional Name: 4-(2-citraconimidoethyl)benzoic acid Formula: C14H13NO4 MolecularWeight: 259.25732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)CCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC(=O)N(C1=O)CCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C14H13NO4/c1-9-8-12(16)15(13(9)17)7-6-10-2-4-11(5-3-10)14(18)19/h2-5,8H,6-7H2,1H3,(H,18,19)