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

Systemtic Name: [3-[1-[2-(methanidyloxycarbonylamino)propanoyloxy]-3-methyl-anthracen-2-yl]-3-methyl-butanoyl]boron Openeye Name: [3-[1-[2-(methanidyloxycarbonylamino)propanoyloxy]-3-methyl-2-anthryl]-3-methyl-butanoyl]boron CAS Name: [3-[1-[2-[[methanidyloxy(oxo)methyl]amino]-1-oxopropoxy]-3-methyl-2-anthracenyl]-3-methyl-1-oxobutyl]boron IUPAC Name: [3-[1-[2-(methanidyloxycarbonylamino)propanoyloxy]-3-methylanthracen-2-yl]-3-methylbutanoyl]boron Traditional Name: [3-[1-[2-(methanidyloxycarbonylamino)propanoyloxy]-3-methyl-2-anthryl]-3-methyl-butanoyl]boron Formula: C25H25BNO5- MolecularWeight: 430.2807

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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)O[CH2-]

Isomeric SMILES

[B]C(=O)CC(C)(C)C1=C(C2=CC3=CC=CC=C3C=C2C=C1C)OC(=O)C(C)NC(=O)O[CH2-]

InChI

InChI=1S/C25H25BNO5/c1-14-10-18-11-16-8-6-7-9-17(16)12-19(18)22(21(14)25(3,4)13-20(26)28)32-23(29)15(2)27-24(30)31-5/h6-12,15H,5,13H2,1-4H3,(H,27,30)/q-1