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

Systemtic Name: [[(3Z)-3-[4-(dimethylaminomethyl)benzimidazol-2-ylidene]-5-isoquinolin-4-yl-2H-indazol-1-yl]-methyl-phosphanyl]boron Openeye Name: [[(3Z)-3-[4-(dimethylaminomethyl)benzimidazol-2-ylidene]-5-(4-isoquinolyl)-2H-indazol-1-yl]-methyl-phosphanyl]boron CAS Name: [[(3Z)-3-[4-(dimethylaminomethyl)-2-benzimidazolylidene]-5-(4-isoquinolinyl)-2H-indazol-1-yl]-methylphosphino]boron IUPAC Name: [[(3Z)-3-[4-(dimethylaminomethyl)benzimidazol-2-ylidene]-5-isoquinolin-4-yl-2H-indazol-1-yl]-methylphosphanyl]boron Traditional Name: [[(3Z)-3-[4-(dimethylaminomethyl)benzimidazol-2-ylidene]-5-(4-isoquinolyl)indazolin-1-yl]-methyl-phosphino]boron Formula: C27H24BN6P MolecularWeight: 474.304421

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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)CN(C)C)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)CN(C)C)/N1

InChI

InChI=1S/C27H24BN6P/c1-33(2)16-19-8-6-10-23-25(19)31-27(30-23)26-21-13-17(11-12-24(21)34(32-26)35(3)28)22-15-29-14-18-7-4-5-9-20(18)22/h4-15,32H,16H2,1-3H3/b27-26-