cyano-[2-[(1-methoxycarbonyl-2,3-dihydroindol-3-yl)methyl]-5-methoxycarbonyloxy-pyridin-1-ium-1-yl]boranide

Systemtic Name: cyano-[2-[(1-methoxycarbonyl-2,3-dihydroindol-3-yl)methyl]-5-methoxycarbonyloxy-pyridin-1-ium-1-yl]boranide Openeye Name: cyano-[2-[(1-methoxycarbonylindolin-3-yl)methyl]-5-methoxycarbonyloxy-pyridin-1-ium-1-yl]boranide CAS Name: cyano-[2-[(1-methoxycarbonyl-2,3-dihydroindol-3-yl)methyl]-5-methoxycarbonyloxy-1-pyridin-1-iumyl]boranide IUPAC Name: cyano-[2-[(1-methoxycarbonyl-2,3-dihydroindol-3-yl)methyl]-5-methoxycarbonyloxypyridin-1-ium-1-yl]boranide Traditional Name: [2-[(1-carbomethoxyindolin-3-yl)methyl]-5-carbomethoxyoxy-pyridin-1-ium-1-yl]-cyano-boranide Formula: C19H18BN3O5 MolecularWeight: 379.17432

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C#N)[N+]1=C(C=CC(=C1)OC(=O)OC)CC2CN(C3=CC=CC=C23)C(=O)OC

Isomeric SMILES

[B-](C#N)[N+]1=C(C=CC(=C1)OC(=O)OC)CC2CN(C3=CC=CC=C23)C(=O)OC

InChI

InChI=1S/C19H18BN3O5/c1-26-18(24)22-10-13(16-5-3-4-6-17(16)22)9-14-7-8-15(28-19(25)27-2)11-23(14)20-12-21/h3-8,11,13H,9-10H2,1-2H3