4-(oct-2-ynylamino)-2H-phthalazin-1-one

Systemtic Name: 4-(oct-2-ynylamino)-2H-phthalazin-1-one Openeye Name: 4-(oct-2-ynylamino)-2H-phthalazin-1-one CAS Name: 4-(oct-2-ynylamino)-2H-phthalazin-1-one IUPAC Name: 4-(oct-2-ynylamino)-2H-phthalazin-1-one Traditional Name: 4-(oct-2-ynylamino)-2H-phthalazin-1-one Formula: C16H19N3O MolecularWeight: 269.34156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CCNC1=NNC(=O)C2=CC=CC=C21

Isomeric SMILES

CCCCCC#CCNC1=NNC(=O)C2=CC=CC=C21

InChI

InChI=1S/C16H19N3O/c1-2-3-4-5-6-9-12-17-15-13-10-7-8-11-14(13)16(20)19-18-15/h7-8,10-11H,2-5,12H2,1H3,(H,17,18)(H,19,20)