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

Systemtic Name: 4-[[3-methyl-2,5-bis(oxidanylidene)pyrrol-1-yl]methyl]benzoic acid Openeye Name: 4-[(3-methyl-2,5-dioxo-pyrrol-1-yl)methyl]benzoic acid CAS Name: 4-[(3-methyl-2,5-dioxo-1-pyrrolyl)methyl]benzoic acid IUPAC Name: 4-[(3-methyl-2,5-dioxopyrrol-1-yl)methyl]benzoic acid Traditional Name: 4-(citraconimidomethyl)benzoic acid Formula: C13H11NO4 MolecularWeight: 245.23074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(C1=O)CC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC(=O)N(C1=O)CC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H11NO4/c1-8-6-11(15)14(12(8)16)7-9-2-4-10(5-3-9)13(17)18/h2-6H,7H2,1H3,(H,17,18)