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

Systemtic Name: N-(3,4-dichlorophenyl)-4-(4-methoxy-3-nitro-phenyl)phthalazin-1-amine Openeye Name: N-(3,4-dichlorophenyl)-4-(4-methoxy-3-nitro-phenyl)phthalazin-1-amine CAS Name: N-(3,4-dichlorophenyl)-4-(4-methoxy-3-nitrophenyl)-1-phthalazinamine IUPAC Name: N-(3,4-dichlorophenyl)-4-(4-methoxy-3-nitrophenyl)phthalazin-1-amine Traditional Name: (3,4-dichlorophenyl)-[4-(4-methoxy-3-nitro-phenyl)phthalazin-1-yl]amine Formula: C21H14Cl2N4O3 MolecularWeight: 441.26686

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)Cl)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC(=C(C=C4)Cl)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H14Cl2N4O3/c1-30-19-9-6-12(10-18(19)27(28)29)20-14-4-2-3-5-15(14)21(26-25-20)24-13-7-8-16(22)17(23)11-13/h2-11H,1H3,(H,24,26)