2-methyl-4-(4-morpholin-4-yl-3-nitro-phenyl)phthalazin-1-one

Systemtic Name: 2-methyl-4-(4-morpholin-4-yl-3-nitro-phenyl)phthalazin-1-one Openeye Name: 2-methyl-4-(4-morpholino-3-nitro-phenyl)phthalazin-1-one CAS Name: 2-methyl-4-[4-(4-morpholinyl)-3-nitrophenyl]-1-phthalazinone IUPAC Name: 2-methyl-4-(4-morpholin-4-yl-3-nitrophenyl)phthalazin-1-one Traditional Name: 2-methyl-4-(4-morpholino-3-nitro-phenyl)phthalazin-1-one Formula: C19H18N4O4 MolecularWeight: 366.37062

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C3=CC(=C(C=C3)N4CCOCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N4O4/c1-21-19(24)15-5-3-2-4-14(15)18(20-21)13-6-7-16(17(12-13)23(25)26)22-8-10-27-11-9-22/h2-7,12H,8-11H2,1H3