[4-[(3,5-ditert-butylphenyl)methyl]piperazin-1-yl]-methyl-borinic acid

Systemtic Name: [4-[(3,5-ditert-butylphenyl)methyl]piperazin-1-yl]-methyl-borinic acid Openeye Name: [4-[(3,5-ditert-butylphenyl)methyl]piperazin-1-yl]-methyl-borinic acid CAS Name: [4-[(3,5-ditert-butylphenyl)methyl]-1-piperazinyl]-methylborinic acid IUPAC Name: [4-[(3,5-ditert-butylphenyl)methyl]piperazin-1-yl]-methylborinic acid Traditional Name: [4-(3,5-ditert-butylbenzyl)piperazino]-methyl-borinic acid Formula: C20H35BN2O MolecularWeight: 330.3157

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Descriptors Computed from Structure

Canonical SMILES:

B(C)(N1CCN(CC1)CC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)O

Isomeric SMILES

B(C)(N1CCN(CC1)CC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C)O

InChI

InChI=1S/C20H35BN2O/c1-19(2,3)17-12-16(13-18(14-17)20(4,5)6)15-22-8-10-23(11-9-22)21(7)24/h12-14,24H,8-11,15H2,1-7H3