3-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(4-morpholinoanilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-[4-(4-morpholinyl)anilino]-2-oxoethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-[2-keto-2-(4-morpholinoanilino)ethyl]phthalazine-1-carboxylate Formula: C21H19N4O5- MolecularWeight: 407.39936

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-]

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)CN3C(=O)C4=CC=CC=C4C(=N3)C(=O)[O-]

InChI

InChI=1S/C21H20N4O5/c26-18(22-14-5-7-15(8-6-14)24-9-11-30-12-10-24)13-25-20(27)17-4-2-1-3-16(17)19(23-25)21(28)29/h1-8H,9-13H2,(H,22,26)(H,28,29)/p-1