1-cyano-3,4,4-trimethyl-1H-phthalazine-2-carbonyl chloride

Systemtic Name: 1-cyano-3,4,4-trimethyl-1H-phthalazine-2-carbonyl chloride Openeye Name: 1-cyano-3,4,4-trimethyl-1H-phthalazine-2-carbonyl chloride CAS Name: 1-cyano-3,4,4-trimethyl-1H-phthalazine-2-carbonyl chloride IUPAC Name: 1-cyano-3,4,4-trimethyl-1H-phthalazine-2-carbonyl chloride Traditional Name: 1-cyano-3,4,4-trimethyl-1H-phthalazine-2-carbonyl chloride Formula: C13H14ClN3O MolecularWeight: 263.72276

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2C(N(N1C)C(=O)Cl)C#N)C

Isomeric SMILES

CC1(C2=CC=CC=C2C(N(N1C)C(=O)Cl)C#N)C

InChI

InChI=1S/C13H14ClN3O/c1-13(2)10-7-5-4-6-9(10)11(8-15)17(12(14)18)16(13)3/h4-7,11H,1-3H3