phenyl 4-(2-diethylboranyl-2-ethyl-1,3-dimethyl-indol-3-yl)-4H-pyridine-1-carboxylate

Systemtic Name: phenyl 4-(2-diethylboranyl-2-ethyl-1,3-dimethyl-indol-3-yl)-4H-pyridine-1-carboxylate Openeye Name: phenyl 4-(2-diethylboranyl-2-ethyl-1,3-dimethyl-indolin-3-yl)-4H-pyridine-1-carboxylate CAS Name: 4-(2-diethylboranyl-2-ethyl-1,3-dimethyl-3-indolyl)-4H-pyridine-1-carboxylic acid phenyl ester IUPAC Name: phenyl 4-(2-diethylboranyl-2-ethyl-1,3-dimethylindol-3-yl)-4H-pyridine-1-carboxylate Traditional Name: 4-(2-diethylboranyl-2-ethyl-1,3-dimethyl-indolin-3-yl)-4H-pyridine-1-carboxylic acid phenyl ester Formula: C28H35BN2O2 MolecularWeight: 442.4007

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Descriptors Computed from Structure

Canonical SMILES:

B(CC)(CC)C1(C(C2=CC=CC=C2N1C)(C)C3C=CN(C=C3)C(=O)OC4=CC=CC=C4)CC

Isomeric SMILES

B(CC)(CC)C1(C(C2=CC=CC=C2N1C)(C)C3C=CN(C=C3)C(=O)OC4=CC=CC=C4)CC

InChI

InChI=1S/C28H35BN2O2/c1-6-28(29(7-2)8-3)27(4,24-16-12-13-17-25(24)30(28)5)22-18-20-31(21-19-22)26(32)33-23-14-10-9-11-15-23/h9-22H,6-8H2,1-5H3