4-[1-(4-cyanobutyl)pyrrol-2-yl]-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-[1-(4-cyanobutyl)pyrrol-2-yl]-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-[1-(4-cyanobutyl)pyrrol-2-yl]-2,4-dioxo-butanoic acid CAS Name: 4-[1-(4-cyanobutyl)-2-pyrrolyl]-2,4-dioxobutanoic acid IUPAC Name: 4-[1-(4-cyanobutyl)pyrrol-2-yl]-2,4-dioxobutanoic acid Traditional Name: 4-[1-(4-cyanobutyl)pyrrol-2-yl]-2,4-diketo-butyric acid Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C(=O)CC(=O)C(=O)O)CCCCC#N

Isomeric SMILES

C1=CN(C(=C1)C(=O)CC(=O)C(=O)O)CCCCC#N

InChI

InChI=1S/C13H14N2O4/c14-6-2-1-3-7-15-8-4-5-10(15)11(16)9-12(17)13(18)19/h4-5,8H,1-3,7,9H2,(H,18,19)