[3-[1-(2-acetamidopropanoyloxy)-3-methyl-anthracen-2-yl]-3-methyl-butanoyl]boron

Systemtic Name: [3-[1-(2-acetamidopropanoyloxy)-3-methyl-anthracen-2-yl]-3-methyl-butanoyl]boron Openeye Name: [3-[1-(2-acetamidopropanoyloxy)-3-methyl-2-anthryl]-3-methyl-butanoyl]boron CAS Name: [3-[1-(2-acetamido-1-oxopropoxy)-3-methyl-2-anthracenyl]-3-methyl-1-oxobutyl]boron IUPAC Name: [3-[1-(2-acetamidopropanoyloxy)-3-methylanthracen-2-yl]-3-methylbutanoyl]boron Traditional Name: [3-[1-(2-acetamidopropanoyloxy)-3-methyl-2-anthryl]-3-methyl-butanoyl]boron Formula: C25H26BNO4 MolecularWeight: 415.28924

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Descriptors Computed from Structure

Canonical SMILES:

[B]C(=O)CC(C)(C)C1=C(C2=CC3=CC=CC=C3C=C2C=C1C)OC(=O)C(C)NC(=O)C

Isomeric SMILES

[B]C(=O)CC(C)(C)C1=C(C2=CC3=CC=CC=C3C=C2C=C1C)OC(=O)C(C)NC(=O)C

InChI

InChI=1S/C25H26BNO4/c1-14-10-19-11-17-8-6-7-9-18(17)12-20(19)23(22(14)25(4,5)13-21(26)29)31-24(30)15(2)27-16(3)28/h6-12,15H,13H2,1-5H3,(H,27,28)