3-[3-[(6-morpholin-4-ylpyridin-3-yl)amino]-3-oxidanylidene-propyl]-4-oxidanylidene-phthalazin-1-olate

Systemtic Name: 3-[3-[(6-morpholin-4-ylpyridin-3-yl)amino]-3-oxidanylidene-propyl]-4-oxidanylidene-phthalazin-1-olate Openeye Name: 3-[3-[(6-morpholino-3-pyridyl)amino]-3-oxo-propyl]-4-oxo-phthalazin-1-olate CAS Name: 3-[3-[[6-(4-morpholinyl)-3-pyridinyl]amino]-3-oxopropyl]-4-oxo-1-phthalazinolate IUPAC Name: 3-[3-[(6-morpholin-4-ylpyridin-3-yl)amino]-3-oxopropyl]-4-oxophthalazin-1-olate Traditional Name: 4-keto-3-[3-keto-3-[(6-morpholino-3-pyridyl)amino]propyl]phthalazin-1-olate Formula: C20H20N5O4- MolecularWeight: 394.4039

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=N3)[O-]

Isomeric SMILES

C1COCCN1C2=NC=C(C=C2)NC(=O)CCN3C(=O)C4=CC=CC=C4C(=N3)[O-]

InChI

InChI=1S/C20H21N5O4/c26-18(22-14-5-6-17(21-13-14)24-9-11-29-12-10-24)7-8-25-20(28)16-4-2-1-3-15(16)19(27)23-25/h1-6,13H,7-12H2,(H,22,26)(H,23,27)/p-1