N-(3,4-dichlorophenyl)-4-(4-morpholin-4-yl-3-nitro-phenyl)phthalazin-1-amine

Systemtic Name: N-(3,4-dichlorophenyl)-4-(4-morpholin-4-yl-3-nitro-phenyl)phthalazin-1-amine Openeye Name: N-(3,4-dichlorophenyl)-4-(4-morpholino-3-nitro-phenyl)phthalazin-1-amine CAS Name: N-(3,4-dichlorophenyl)-4-[4-(4-morpholinyl)-3-nitrophenyl]-1-phthalazinamine IUPAC Name: N-(3,4-dichlorophenyl)-4-(4-morpholin-4-yl-3-nitrophenyl)phthalazin-1-amine Traditional Name: (3,4-dichlorophenyl)-[4-(4-morpholino-3-nitro-phenyl)phthalazin-1-yl]amine Formula: C24H19Cl2N5O3 MolecularWeight: 496.34536

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C3=NN=C(C4=CC=CC=C43)NC5=CC(=C(C=C5)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)C3=NN=C(C4=CC=CC=C43)NC5=CC(=C(C=C5)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H19Cl2N5O3/c25-19-7-6-16(14-20(19)26)27-24-18-4-2-1-3-17(18)23(28-29-24)15-5-8-21(22(13-15)31(32)33)30-9-11-34-12-10-30/h1-8,13-14H,9-12H2,(H,27,29)