1-[butyl(ethyl)amino]-3-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)propan-2-ol; ethanedioic acid

Systemtic Name: 1-[butyl(ethyl)amino]-3-(4-chloranyl-5-methyl-2-propan-2-yl-phenoxy)propan-2-ol; ethanedioic acid Openeye Name: 1-[butyl(ethyl)amino]-3-(4-chloro-2-isopropyl-5-methyl-phenoxy)propan-2-ol; oxalic acid CAS Name: 1-[butyl(ethyl)amino]-3-(4-chloro-5-methyl-2-propan-2-ylphenoxy)-2-propanol; oxalic acid IUPAC Name: 1-[butyl(ethyl)amino]-3-(4-chloro-5-methyl-2-propan-2-ylphenoxy)propan-2-ol; oxalic acid Traditional Name: 1-[butyl(ethyl)amino]-3-(4-chloro-2-isopropyl-5-methyl-phenoxy)propan-2-ol; oxalic acid Formula: C21H34ClNO6 MolecularWeight: 431.95076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)CC(COC1=C(C=C(C(=C1)C)Cl)C(C)C)O.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCN(CC)CC(COC1=C(C=C(C(=C1)C)Cl)C(C)C)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H32ClNO2.C2H2O4/c1-6-8-9-21(7-2)12-16(22)13-23-19-10-15(5)18(20)11-17(19)14(3)4;3-1(4)2(5)6/h10-11,14,16,22H,6-9,12-13H2,1-5H3;(H,3,4)(H,5,6)