4-[[6-methyl-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyrimidin-4-yl]oxy]butanoic acid

Systemtic Name: 4-[[6-methyl-2-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)-1H-pyrimidin-4-yl]oxy]butanoic acid Openeye Name: 4-[[6-methyl-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyrimidin-4-yl]oxy]butanoic acid CAS Name: 4-[[6-methyl-2-(4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyrimidin-4-yl]oxy]butanoic acid IUPAC Name: 4-[[6-methyl-2-(4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyrimidin-4-yl]oxy]butanoic acid Traditional Name: 4-[[2-(4-ketocyclohexa-2,5-dien-1-ylidene)-6-methyl-1H-pyrimidin-4-yl]oxy]butyric acid Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C2C=CC(=O)C=C2)N1)OCCCC(=O)O

Isomeric SMILES

CC1=CC(=NC(=C2C=CC(=O)C=C2)N1)OCCCC(=O)O

InChI

InChI=1S/C15H16N2O4/c1-10-9-13(21-8-2-3-14(19)20)17-15(16-10)11-4-6-12(18)7-5-11/h4-7,9,16H,2-3,8H2,1H3,(H,19,20)