5-hex-1-ynyl-1-(phenylmethyl)pyrimidine-2,4-dione

Systemtic Name: 5-hex-1-ynyl-1-(phenylmethyl)pyrimidine-2,4-dione Openeye Name: 1-benzyl-5-hex-1-ynyl-pyrimidine-2,4-dione CAS Name: 5-hex-1-ynyl-1-(phenylmethyl)pyrimidine-2,4-dione IUPAC Name: 1-benzyl-5-hex-1-ynylpyrimidine-2,4-dione Traditional Name: 1-benzyl-5-hex-1-ynyl-pyrimidine-2,4-quinone Formula: C17H18N2O2 MolecularWeight: 282.33702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC#CC1=CN(C(=O)NC1=O)CC2=CC=CC=C2

Isomeric SMILES

CCCCC#CC1=CN(C(=O)NC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C17H18N2O2/c1-2-3-4-8-11-15-13-19(17(21)18-16(15)20)12-14-9-6-5-7-10-14/h5-7,9-10,13H,2-4,12H2,1H3,(H,18,20,21)