[[(3Z)-3-(4-chloranylbenzimidazol-2-ylidene)-5-isoquinolin-4-yl-2H-indazol-1-yl]-methyl-phosphanyl]boron

Systemtic Name: [[(3Z)-3-(4-chloranylbenzimidazol-2-ylidene)-5-isoquinolin-4-yl-2H-indazol-1-yl]-methyl-phosphanyl]boron Openeye Name: [[(3Z)-3-(4-chlorobenzimidazol-2-ylidene)-5-(4-isoquinolyl)-2H-indazol-1-yl]-methyl-phosphanyl]boron CAS Name: [[(3Z)-3-(4-chloro-2-benzimidazolylidene)-5-(4-isoquinolinyl)-2H-indazol-1-yl]-methylphosphino]boron IUPAC Name: [[(3Z)-3-(4-chlorobenzimidazol-2-ylidene)-5-isoquinolin-4-yl-2H-indazol-1-yl]-methylphosphanyl]boron Traditional Name: [[(3Z)-3-(4-chlorobenzimidazol-2-ylidene)-5-(4-isoquinolyl)indazolin-1-yl]-methyl-phosphino]boron Formula: C24H16BClN5P MolecularWeight: 451.655101

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Descriptors Computed from Structure

Canonical SMILES:

[B]P(C)N1C2=C(C=C(C=C2)C3=CN=CC4=CC=CC=C43)C(=C5N=C6C=CC=C(C6=N5)Cl)N1

Isomeric SMILES

[B]P(C)N1C2=C(C=C(C=C2)C3=CN=CC4=CC=CC=C43)/C(=C/5\N=C6C=CC=C(C6=N5)Cl)/N1

InChI

InChI=1S/C24H16BClN5P/c1-32(25)31-21-10-9-14(18-13-27-12-15-5-2-3-6-16(15)18)11-17(21)22(30-31)24-28-20-8-4-7-19(26)23(20)29-24/h2-13,30H,1H3/b24-22-