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

Systemtic Name: 4-[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]butanoic acid Openeye Name: 4-(3-methyl-2,5-dioxo-pyrrol-1-yl)butanoic acid CAS Name: 4-(3-methyl-2,5-dioxo-1-pyrrolyl)butanoic acid IUPAC Name: 4-(3-methyl-2,5-dioxopyrrol-1-yl)butanoic acid Traditional Name: 4-citraconimidobutyric acid Formula: C9H11NO4 MolecularWeight: 197.18794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H11NO4/c1-6-5-7(11)10(9(6)14)4-2-3-8(12)13/h5H,2-4H2,1H3,(H,12,13)