1-(2-hydroxyethyloxymethyl)-5-[3-(4-methylphenyl)-3-oxidanylidene-prop-1-ynyl]pyrimidine-2,4-dione

Systemtic Name: 1-(2-hydroxyethyloxymethyl)-5-[3-(4-methylphenyl)-3-oxidanylidene-prop-1-ynyl]pyrimidine-2,4-dione Openeye Name: 1-(2-hydroxyethoxymethyl)-5-[3-oxo-3-(p-tolyl)prop-1-ynyl]pyrimidine-2,4-dione CAS Name: 1-(2-hydroxyethoxymethyl)-5-[3-(4-methylphenyl)-3-oxoprop-1-ynyl]pyrimidine-2,4-dione IUPAC Name: 1-(2-hydroxyethoxymethyl)-5-[3-(4-methylphenyl)-3-oxoprop-1-ynyl]pyrimidine-2,4-dione Traditional Name: 1-(2-hydroxyethoxymethyl)-5-[3-keto-3-(p-tolyl)prop-1-ynyl]pyrimidine-2,4-quinone Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C#CC2=CN(C(=O)NC2=O)COCCO

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C#CC2=CN(C(=O)NC2=O)COCCO

InChI

InChI=1S/C17H16N2O5/c1-12-2-4-13(5-3-12)15(21)7-6-14-10-19(11-24-9-8-20)17(23)18-16(14)22/h2-5,10,20H,8-9,11H2,1H3,(H,18,22,23)