N-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]-2-morpholin-4-yl-ethanamine; ethanedioic acid

Systemtic Name: N-[2-(4-chloranyl-2-prop-2-enyl-phenoxy)ethyl]-2-morpholin-4-yl-ethanamine; ethanedioic acid Openeye Name: N-[2-(2-allyl-4-chloro-phenoxy)ethyl]-2-morpholino-ethanamine; oxalic acid CAS Name: N-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]-2-(4-morpholinyl)ethanamine; oxalic acid IUPAC Name: N-[2-(4-chloro-2-prop-2-enylphenoxy)ethyl]-2-morpholin-4-ylethanamine; oxalic acid Traditional Name: 2-(2-allyl-4-chloro-phenoxy)ethyl-(2-morpholinoethyl)amine; oxalic acid Formula: C19H27ClN2O6 MolecularWeight: 414.88048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC(=C1)Cl)OCCNCCN2CCOCC2.C(=O)(C(=O)O)O

Isomeric SMILES

C=CCC1=C(C=CC(=C1)Cl)OCCNCCN2CCOCC2.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H25ClN2O2.C2H2O4/c1-2-3-15-14-16(18)4-5-17(15)22-11-7-19-6-8-20-9-12-21-13-10-20;3-1(4)2(5)6/h2,4-5,14,19H,1,3,6-13H2;(H,3,4)(H,5,6)