N-(3-ethylpent-1-yn-3-yl)-4-oxidanylidene-3H-phthalazine-1-carboxamide

Systemtic Name: N-(3-ethylpent-1-yn-3-yl)-4-oxidanylidene-3H-phthalazine-1-carboxamide Openeye Name: N-(1,1-diethylprop-2-ynyl)-4-oxo-3H-phthalazine-1-carboxamide CAS Name: N-(3-ethylpent-1-yn-3-yl)-4-oxo-3H-phthalazine-1-carboxamide IUPAC Name: N-(3-ethylpent-1-yn-3-yl)-4-oxo-3H-phthalazine-1-carboxamide Traditional Name: N-(1,1-diethylprop-2-ynyl)-4-keto-3H-phthalazine-1-carboxamide Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)C1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CCC(CC)(C#C)NC(=O)C1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C16H17N3O2/c1-4-16(5-2,6-3)17-15(21)13-11-9-7-8-10-12(11)14(20)19-18-13/h1,7-10H,5-6H2,2-3H3,(H,17,21)(H,19,20)