7-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]heptanoic acid

Systemtic Name: 7-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]heptanoic acid Openeye Name: 7-(3-methyl-2,5-dioxo-pyrrol-1-yl)heptanoic acid CAS Name: 7-(3-methyl-2,5-dioxo-1-pyrrolyl)heptanoic acid IUPAC Name: 7-(3-methyl-2,5-dioxopyrrol-1-yl)heptanoic acid Traditional Name: 7-citraconimidoenanthic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)CCCCCCC(=O)O

Isomeric SMILES

CC1=CC(=O)N(C1=O)CCCCCCC(=O)O

InChI

InChI=1S/C12H17NO4/c1-9-8-10(14)13(12(9)17)7-5-3-2-4-6-11(15)16/h8H,2-7H2,1H3,(H,15,16)