5-[(3-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(3-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Openeye Name: 5-[(3-prop-2-ynoxyphenyl)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(3-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(3-prop-2-ynoxyphenyl)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 5-(3-propargyloxybenzylidene)barbituric acid Formula: C14H10N2O4 MolecularWeight: 270.2402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCOC1=CC=CC(=C1)C=C2C(=O)NC(=O)NC2=O

Isomeric SMILES

C#CCOC1=CC=CC(=C1)C=C2C(=O)NC(=O)NC2=O

InChI

InChI=1S/C14H10N2O4/c1-2-6-20-10-5-3-4-9(7-10)8-11-12(17)15-14(19)16-13(11)18/h1,3-5,7-8H,6H2,(H2,15,16,17,18,19)