ethyl 1-ethynyl-1H-phthalazine-2-carboxylate

Systemtic Name: ethyl 1-ethynyl-1H-phthalazine-2-carboxylate Openeye Name: ethyl 1-ethynyl-1H-phthalazine-2-carboxylate CAS Name: 1-ethynyl-1H-phthalazine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 1-ethynyl-1H-phthalazine-2-carboxylate Traditional Name: 1-ethynyl-1H-phthalazine-2-carboxylic acid ethyl ester Formula: C13H12N2O2 MolecularWeight: 228.24658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C(C2=CC=CC=C2C=N1)C#C

Isomeric SMILES

CCOC(=O)N1C(C2=CC=CC=C2C=N1)C#C

InChI

InChI=1S/C13H12N2O2/c1-3-12-11-8-6-5-7-10(11)9-14-15(12)13(16)17-4-2/h1,5-9,12H,4H2,2H3