4-chloranyl-N-[(3-chloranyl-4-methoxy-phenyl)methyl]-6-nitro-phthalazin-1-amine

Systemtic Name: 4-chloranyl-N-[(3-chloranyl-4-methoxy-phenyl)methyl]-6-nitro-phthalazin-1-amine Openeye Name: 4-chloro-N-[(3-chloro-4-methoxy-phenyl)methyl]-6-nitro-phthalazin-1-amine CAS Name: 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-6-nitro-1-phthalazinamine IUPAC Name: 4-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-6-nitrophthalazin-1-amine Traditional Name: (3-chloro-4-methoxy-benzyl)-(4-chloro-6-nitro-phthalazin-1-yl)amine Formula: C16H12Cl2N4O3 MolecularWeight: 379.19748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=CC(=C3)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=CC(=C3)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C16H12Cl2N4O3/c1-25-14-5-2-9(6-13(14)17)8-19-16-11-4-3-10(22(23)24)7-12(11)15(18)20-21-16/h2-7H,8H2,1H3,(H,19,21)