5-[5-isocyano-1-(oxidanylideneboranylmethyl)pyrrol-2-yl]spiro[1H-indole-3,1'-cyclopentane]-2-one

Systemtic Name: 5-[5-isocyano-1-(oxidanylideneboranylmethyl)pyrrol-2-yl]spiro[1H-indole-3,1'-cyclopentane]-2-one Openeye Name: 5'-[5-isocyano-1-(oxoboranylmethyl)pyrrol-2-yl]spiro[cyclopentane-1,3'-indoline]-2'-one CAS Name: 5-[5-isocyano-1-(oxoboranylmethyl)-2-pyrrolyl]-2-spiro[1H-indole-3,1'-cyclopentane]one IUPAC Name: 5-[5-isocyano-1-(oxoboranylmethyl)pyrrol-2-yl]spiro[1H-indole-3,1'-cyclopentane]-2-one Traditional Name: 5'-[5-isocyano-1-(ketoboranylmethyl)pyrrol-2-yl]spiro[cyclopentane-1,3'-indoline]-2'-one Formula: C18H16BN3O2 MolecularWeight: 317.14954

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Descriptors Computed from Structure

Canonical SMILES:

B(=O)CN1C(=CC=C1[N+]#[C-])C2=CC3=C(C=C2)NC(=O)C34CCCC4

Isomeric SMILES

B(=O)CN1C(=CC=C1[N+]#[C-])C2=CC3=C(C=C2)NC(=O)C34CCCC4

InChI

InChI=1S/C18H16BN3O2/c1-20-16-7-6-15(22(16)11-19-24)12-4-5-14-13(10-12)18(17(23)21-14)8-2-3-9-18/h4-7,10H,2-3,8-9,11H2,(H,21,23)