2-bis(3-chloranyl-4-methyl-phenyl)boranyloxy-3-(4-chloranylphenoxy)-N-methyl-propan-1-amine

Systemtic Name: 2-bis(3-chloranyl-4-methyl-phenyl)boranyloxy-3-(4-chloranylphenoxy)-N-methyl-propan-1-amine Openeye Name: 2-bis(3-chloro-4-methyl-phenyl)boranyloxy-3-(4-chlorophenoxy)-N-methyl-propan-1-amine CAS Name: 2-bis(3-chloro-4-methylphenyl)boranyloxy-3-(4-chlorophenoxy)-N-methyl-1-propanamine IUPAC Name: 2-bis(3-chloro-4-methylphenyl)boranyloxy-3-(4-chlorophenoxy)-N-methylpropan-1-amine Traditional Name: [2-bis(3-chloro-4-methyl-phenyl)boranyloxy-3-(4-chlorophenoxy)propyl]-methyl-amine Formula: C24H25BCl3NO2 MolecularWeight: 476.6308

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)OC(CNC)COC3=CC=C(C=C3)Cl

Isomeric SMILES

B(C1=CC(=C(C=C1)C)Cl)(C2=CC(=C(C=C2)C)Cl)OC(CNC)COC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H25BCl3NO2/c1-16-4-6-18(12-23(16)27)25(19-7-5-17(2)24(28)13-19)31-22(14-29-3)15-30-21-10-8-20(26)9-11-21/h4-13,22,29H,14-15H2,1-3H3