2-[3-(4-butylphenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]ethanoic acid

Systemtic Name: 2-[3-(4-butylphenyl)-2,4-bis(oxidanylidene)-1H-pyrimidin-5-yl]ethanoic acid Openeye Name: 2-[3-(4-butylphenyl)-2,4-dioxo-1H-pyrimidin-5-yl]acetic acid CAS Name: 2-[3-(4-butylphenyl)-2,4-dioxo-1H-pyrimidin-5-yl]acetic acid IUPAC Name: 2-[3-(4-butylphenyl)-2,4-dioxo-1H-pyrimidin-5-yl]acetic acid Traditional Name: 2-[3-(4-butylphenyl)-2,4-diketo-1H-pyrimidin-5-yl]acetic acid Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)N2C(=O)C(=CNC2=O)CC(=O)O

Isomeric SMILES

CCCCC1=CC=C(C=C1)N2C(=O)C(=CNC2=O)CC(=O)O

InChI

InChI=1S/C16H18N2O4/c1-2-3-4-11-5-7-13(8-6-11)18-15(21)12(9-14(19)20)10-17-16(18)22/h5-8,10H,2-4,9H2,1H3,(H,17,22)(H,19,20)