4-(3-chloranyl-4-methoxy-phenyl)-2-(1H-indazol-5-yl)-4a,5,8,8a-tetrahydrophthalazin-1-one

Systemtic Name: 4-(3-chloranyl-4-methoxy-phenyl)-2-(1H-indazol-5-yl)-4a,5,8,8a-tetrahydrophthalazin-1-one Openeye Name: 4-(3-chloro-4-methoxy-phenyl)-2-(1H-indazol-5-yl)-4a,5,8,8a-tetrahydrophthalazin-1-one CAS Name: 4-(3-chloro-4-methoxyphenyl)-2-(1H-indazol-5-yl)-4a,5,8,8a-tetrahydrophthalazin-1-one IUPAC Name: 4-(3-chloro-4-methoxyphenyl)-2-(1H-indazol-5-yl)-4a,5,8,8a-tetrahydrophthalazin-1-one Traditional Name: 4-(3-chloro-4-methoxy-phenyl)-2-(1H-indazol-5-yl)-4a,5,8,8a-tetrahydrophthalazin-1-one Formula: C22H19ClN4O2 MolecularWeight: 406.86486

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CC=CC3)C4=CC5=C(C=C4)NN=C5)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=O)C3C2CC=CC3)C4=CC5=C(C=C4)NN=C5)Cl

InChI

InChI=1S/C22H19ClN4O2/c1-29-20-9-6-13(11-18(20)23)21-16-4-2-3-5-17(16)22(28)27(26-21)15-7-8-19-14(10-15)12-24-25-19/h2-3,6-12,16-17H,4-5H2,1H3,(H,24,25)