4-[(4-morpholin-4-yl-3-nitro-phenyl)methylamino]-2H-phthalazin-1-one

Systemtic Name: 4-[(4-morpholin-4-yl-3-nitro-phenyl)methylamino]-2H-phthalazin-1-one Openeye Name: 4-[(4-morpholino-3-nitro-phenyl)methylamino]-2H-phthalazin-1-one CAS Name: 4-[[4-(4-morpholinyl)-3-nitrophenyl]methylamino]-2H-phthalazin-1-one IUPAC Name: 4-[(4-morpholin-4-yl-3-nitrophenyl)methylamino]-2H-phthalazin-1-one Traditional Name: 4-[(4-morpholino-3-nitro-benzyl)amino]-2H-phthalazin-1-one Formula: C19H19N5O4 MolecularWeight: 381.38526

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)CNC3=NNC(=O)C4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)CNC3=NNC(=O)C4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O4/c25-19-15-4-2-1-3-14(15)18(21-22-19)20-12-13-5-6-16(17(11-13)24(26)27)23-7-9-28-10-8-23/h1-6,11H,7-10,12H2,(H,20,21)(H,22,25)