5-bromanyl-2,4-dimethoxy-3-octan-3-yl-benzamide hydrochloride

Systemtic Name: 5-bromanyl-2,4-dimethoxy-3-octan-3-yl-benzamide hydrochloride Openeye Name: 5-bromo-3-(1-ethylhexyl)-2,4-dimethoxy-benzamide hydrochloride CAS Name: 5-bromo-2,4-dimethoxy-3-octan-3-ylbenzamide hydrochloride IUPAC Name: 5-bromo-2,4-dimethoxy-3-octan-3-ylbenzamide hydrochloride Traditional Name: 5-bromo-3-(1-ethylhexyl)-2,4-dimethoxy-benzamide hydrochloride Formula: C17H27BrClNO3 MolecularWeight: 408.75818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)C1=C(C(=CC(=C1OC)Br)C(=O)N)OC.Cl

Isomeric SMILES

CCCCCC(CC)C1=C(C(=CC(=C1OC)Br)C(=O)N)OC.Cl

InChI

InChI=1S/C17H26BrNO3.ClH/c1-5-7-8-9-11(6-2)14-15(21-3)12(17(19)20)10-13(18)16(14)22-4;/h10-11H,5-9H2,1-4H3,(H2,19,20);1H