4-[4-(4-bromanyl-2-methyl-phenoxy)butyl]morpholine; ethanedioic acid

Systemtic Name: 4-[4-(4-bromanyl-2-methyl-phenoxy)butyl]morpholine; ethanedioic acid Openeye Name: 4-[4-(4-bromo-2-methyl-phenoxy)butyl]morpholine; oxalic acid CAS Name: 4-[4-(4-bromo-2-methylphenoxy)butyl]morpholine; oxalic acid IUPAC Name: 4-[4-(4-bromo-2-methylphenoxy)butyl]morpholine; oxalic acid Traditional Name: 4-[4-(4-bromo-2-methyl-phenoxy)butyl]morpholine; oxalic acid Formula: C17H24BrNO6 MolecularWeight: 418.27956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)OCCCCN2CCOCC2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=C(C=CC(=C1)Br)OCCCCN2CCOCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H22BrNO2.C2H2O4/c1-13-12-14(16)4-5-15(13)19-9-3-2-6-17-7-10-18-11-8-17;3-1(4)2(5)6/h4-5,12H,2-3,6-11H2,1H3;(H,3,4)(H,5,6)