4-oxidanylidene-N-prop-2-ynyl-3H-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-prop-2-ynyl-3H-phthalazine-1-carboxamide Openeye Name: 4-oxo-N-prop-2-ynyl-3H-phthalazine-1-carboxamide CAS Name: 4-oxo-N-prop-2-ynyl-3H-phthalazine-1-carboxamide IUPAC Name: 4-oxo-N-prop-2-ynyl-3H-phthalazine-1-carboxamide Traditional Name: 4-keto-N-propargyl-3H-phthalazine-1-carboxamide Formula: C12H9N3O2 MolecularWeight: 227.21876

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)C1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

C#CCNC(=O)C1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C12H9N3O2/c1-2-7-13-12(17)10-8-5-3-4-6-9(8)11(16)15-14-10/h1,3-6H,7H2,(H,13,17)(H,15,16)