7-chloranyl-N-[(3-chloranyl-4-methoxy-phenyl)methyl]-4-(pyridin-3-ylmethyl)phthalazin-1-amine

Systemtic Name: 7-chloranyl-N-[(3-chloranyl-4-methoxy-phenyl)methyl]-4-(pyridin-3-ylmethyl)phthalazin-1-amine Openeye Name: 7-chloro-N-[(3-chloro-4-methoxy-phenyl)methyl]-4-(3-pyridylmethyl)phthalazin-1-amine CAS Name: 7-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-4-(3-pyridinylmethyl)-1-phthalazinamine IUPAC Name: 7-chloro-N-[(3-chloro-4-methoxyphenyl)methyl]-4-(pyridin-3-ylmethyl)phthalazin-1-amine Traditional Name: (3-chloro-4-methoxy-benzyl)-[7-chloro-4-(3-pyridylmethyl)phthalazin-1-yl]amine Formula: C22H18Cl2N4O MolecularWeight: 425.31052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=C(C=C3)Cl)CC4=CN=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)CNC2=NN=C(C3=C2C=C(C=C3)Cl)CC4=CN=CC=C4)Cl

InChI

InChI=1S/C22H18Cl2N4O/c1-29-21-7-4-15(9-19(21)24)13-26-22-18-11-16(23)5-6-17(18)20(27-28-22)10-14-3-2-8-25-12-14/h2-9,11-12H,10,13H2,1H3,(H,26,28)