[4-(dioctadecylcarbamoyl)phenyl]boronic acid

Systemtic Name: [4-(dioctadecylcarbamoyl)phenyl]boronic acid Openeye Name: [4-(dioctadecylcarbamoyl)phenyl]boronic acid CAS Name: [4-[(dioctadecylamino)-oxomethyl]phenyl]boronic acid IUPAC Name: [4-(dioctadecylcarbamoyl)phenyl]boronic acid Traditional Name: [4-(distearylcarbamoyl)phenyl]boronic acid Formula: C43H80BNO3 MolecularWeight: 669.9112

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)C(=O)N(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)C(=O)N(CCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC)(O)O

InChI

InChI=1S/C43H80BNO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39-45(43(46)41-35-37-42(38-36-41)44(47)48)40-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-38,47-48H,3-34,39-40H2,1-2H3