N-(4-chloranyl-3-methoxy-phenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine

Systemtic Name: N-(4-chloranyl-3-methoxy-phenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine Openeye Name: N-(4-chloro-3-methoxy-phenyl)-4-(4-pyridylmethyl)phthalazin-1-amine CAS Name: N-(4-chloro-3-methoxyphenyl)-4-(pyridin-4-ylmethyl)-1-phthalazinamine IUPAC Name: N-(4-chloro-3-methoxyphenyl)-4-(pyridin-4-ylmethyl)phthalazin-1-amine Traditional Name: (4-chloro-3-methoxy-phenyl)-[4-(4-pyridylmethyl)phthalazin-1-yl]amine Formula: C21H17ClN4O MolecularWeight: 376.83888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=NN=C(C3=CC=CC=C32)CC4=CC=NC=C4)Cl

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=NN=C(C3=CC=CC=C32)CC4=CC=NC=C4)Cl

InChI

InChI=1S/C21H17ClN4O/c1-27-20-13-15(6-7-18(20)22)24-21-17-5-3-2-4-16(17)19(25-26-21)12-14-8-10-23-11-9-14/h2-11,13H,12H2,1H3,(H,24,26)