3-azanyl-2,4,5-tris(chloranyl)benzoic acid; 2-[2,4-bis(chloranyl)phenoxy]ethanoic acid; 1-[bis(2-oxidanylpropyl)amino]propan-2-ol

Systemtic Name: 3-azanyl-2,4,5-tris(chloranyl)benzoic acid; 2-[2,4-bis(chloranyl)phenoxy]ethanoic acid; 1-[bis(2-oxidanylpropyl)amino]propan-2-ol Openeye Name: 3-amino-2,4,5-trichloro-benzoic acid; 1-[bis(2-hydroxypropyl)amino]propan-2-ol; 2-(2,4-dichlorophenoxy)acetic acid CAS Name: 3-amino-2,4,5-trichlorobenzoic acid; 1-[bis(2-hydroxypropyl)amino]-2-propanol; 2-(2,4-dichlorophenoxy)acetic acid IUPAC Name: 3-amino-2,4,5-trichlorobenzoic acid; 1-[bis(2-hydroxypropyl)amino]propan-2-ol; 2-(2,4-dichlorophenoxy)acetic acid Traditional Name: 3-amino-2,4,5-trichloro-benzoic acid; 1-[bis(2-hydroxypropyl)amino]propan-2-ol; 2-(2,4-dichlorophenoxy)acetic acid Formula: C24H31Cl5N2O8 MolecularWeight: 652.77654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC(C)O)CC(C)O)O.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O.C1=C(C(=C(C(=C1Cl)Cl)N)Cl)C(=O)O

Isomeric SMILES

CC(CN(CC(C)O)CC(C)O)O.C1=CC(=C(C=C1Cl)Cl)OCC(=O)O.C1=C(C(=C(C(=C1Cl)Cl)N)Cl)C(=O)O

InChI

InChI=1S/C9H21NO3.C8H6Cl2O3.C7H4Cl3NO2/c1-7(11)4-10(5-8(2)12)6-9(3)13;9-5-1-2-7(6(10)3-5)13-4-8(11)12;8-3-1-2(7(12)13)4(9)6(11)5(3)10/h7-9,11-13H,4-6H2,1-3H3;1-3H,4H2,(H,11,12);1H,11H2,(H,12,13)