5-chloranyl-4-ethynyl-3-(phenylmethoxymethyl)-1,4-dihydropyrimidin-2-one

Systemtic Name: 5-chloranyl-4-ethynyl-3-(phenylmethoxymethyl)-1,4-dihydropyrimidin-2-one Openeye Name: 3-(benzyloxymethyl)-5-chloro-4-ethynyl-1,4-dihydropyrimidin-2-one CAS Name: 5-chloro-4-ethynyl-3-(phenylmethoxymethyl)-1,4-dihydropyrimidin-2-one IUPAC Name: 5-chloro-4-ethynyl-3-(phenylmethoxymethyl)-1,4-dihydropyrimidin-2-one Traditional Name: 3-(benzoxymethyl)-5-chloro-4-ethynyl-1,4-dihydropyrimidin-2-one Formula: C14H13ClN2O2 MolecularWeight: 276.71822

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1C(=CNC(=O)N1COCC2=CC=CC=C2)Cl

Isomeric SMILES

C#CC1C(=CNC(=O)N1COCC2=CC=CC=C2)Cl

InChI

InChI=1S/C14H13ClN2O2/c1-2-13-12(15)8-16-14(18)17(13)10-19-9-11-6-4-3-5-7-11/h1,3-8,13H,9-10H2,(H,16,18)