(2R,4R)-2,3,4-tris(4-chloranylphenoxy)pentane-1,5-diamine

Systemtic Name: (2R,4R)-2,3,4-tris(4-chloranylphenoxy)pentane-1,5-diamine Openeye Name: (2R,4R)-2,3,4-tris(4-chlorophenoxy)pentane-1,5-diamine CAS Name: (2R,4R)-2,3,4-tris(4-chlorophenoxy)pentane-1,5-diamine IUPAC Name: (2R,4R)-2,3,4-tris(4-chlorophenoxy)pentane-1,5-diamine Traditional Name: [(2R,4R)-5-amino-2,3,4-tris(4-chlorophenoxy)pentyl]amine Formula: C23H23Cl3N2O3 MolecularWeight: 481.79932

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1OC(CN)C(C(CN)OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC(=CC=C1O[C@H](CN)C([C@@H](CN)OC2=CC=C(C=C2)Cl)OC3=CC=C(C=C3)Cl)Cl

InChI

InChI=1S/C23H23Cl3N2O3/c24-15-1-7-18(8-2-15)29-21(13-27)23(31-20-11-5-17(26)6-12-20)22(14-28)30-19-9-3-16(25)4-10-19/h1-12,21-23H,13-14,27-28H2/t21-,22-/m1/s1