3-[2-(4-cyanophenoxy)ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-(4-cyanophenoxy)ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(4-cyanophenoxy)ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-(4-cyanophenoxy)ethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(4-cyanophenoxy)ethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 3-[2-(4-cyanophenoxy)ethyl]-4-keto-phthalazine-1-carboxylate Formula: C18H12N3O4- MolecularWeight: 334.30558

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CCOC3=CC=C(C=C3)C#N)C(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CCOC3=CC=C(C=C3)C#N)C(=O)[O-]

InChI

InChI=1S/C18H13N3O4/c19-11-12-5-7-13(8-6-12)25-10-9-21-17(22)15-4-2-1-3-14(15)16(20-21)18(23)24/h1-8H,9-10H2,(H,23,24)/p-1