tris[1-[butyl-(3-methoxy-4-methyl-phenyl)amino]ethyl]boron(1-)

Systemtic Name: tris[1-[butyl-(3-methoxy-4-methyl-phenyl)amino]ethyl]boron(1-) Openeye Name: tris[1-(N-butyl-3-methoxy-4-methyl-anilino)ethyl]boron(1-) CAS Name: tris[1-(N-butyl-3-methoxy-4-methylanilino)ethyl]boron(1-) IUPAC Name: tris[1-(N-butyl-3-methoxy-4-methylanilino)ethyl]boron(1-) Traditional Name: tris[1-(N-butyl-3-methoxy-4-methyl-anilino)ethyl]boron(1-) Formula: C42H66BN3O3- MolecularWeight: 671.80274

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Descriptors Computed from Structure

Canonical SMILES:

[B-](C(C)N(CCCC)C1=CC(=C(C=C1)C)OC)(C(C)N(CCCC)C2=CC(=C(C=C2)C)OC)C(C)N(CCCC)C3=CC(=C(C=C3)C)OC

Isomeric SMILES

[B-](C(C)N(CCCC)C1=CC(=C(C=C1)C)OC)(C(C)N(CCCC)C2=CC(=C(C=C2)C)OC)C(C)N(CCCC)C3=CC(=C(C=C3)C)OC

InChI

InChI=1S/C42H66BN3O3/c1-13-16-25-44(37-22-19-31(4)40(28-37)47-10)34(7)43(35(8)45(26-17-14-2)38-23-20-32(5)41(29-38)48-11)36(9)46(27-18-15-3)39-24-21-33(6)42(30-39)49-12/h19-24,28-30,34-36H,13-18,25-27H2,1-12H3/q-1