3-cyanopropyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-cyanopropyl 3-ethyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-cyanopropyl 3-ethyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-ethyl-4-oxo-1-phthalazinecarboxylic acid 3-cyanopropyl ester IUPAC Name: 3-cyanopropyl 3-ethyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-ethyl-4-keto-phthalazine-1-carboxylic acid 3-cyanopropyl ester Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCCC#N

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCCCC#N

InChI

InChI=1S/C15H15N3O3/c1-2-18-14(19)12-8-4-3-7-11(12)13(17-18)15(20)21-10-6-5-9-16/h3-4,7-8H,2,5-6,10H2,1H3