2-piperazin-1-ylethanamine; tris(2-methoxyphenyl)borane

Systemtic Name: 2-piperazin-1-ylethanamine; tris(2-methoxyphenyl)borane Openeye Name: 2-piperazin-1-ylethanamine; tris(2-methoxyphenyl)borane CAS Name: 2-(1-piperazinyl)ethanamine; tris(2-methoxyphenyl)borane IUPAC Name: 2-piperazin-1-ylethanamine; tris(2-methoxyphenyl)borane Traditional Name: 2-piperazinoethylamine; tris(2-methoxyphenyl)borane Formula: C27H36BN3O3 MolecularWeight: 461.40404

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=CC=C1OC)(C2=CC=CC=C2OC)C3=CC=CC=C3OC.C1CN(CCN1)CCN

Isomeric SMILES

B(C1=CC=CC=C1OC)(C2=CC=CC=C2OC)C3=CC=CC=C3OC.C1CN(CCN1)CCN

InChI

InChI=1S/C21H21BO3.C6H15N3/c1-23-19-13-7-4-10-16(19)22(17-11-5-8-14-20(17)24-2)18-12-6-9-15-21(18)25-3;7-1-4-9-5-2-8-3-6-9/h4-15H,1-3H3;8H,1-7H2