3-(2-chloranyl-5-methyl-phenoxy)-N-methyl-N-(phenylmethyl)propan-1-amine; ethanedioic acid

Systemtic Name: 3-(2-chloranyl-5-methyl-phenoxy)-N-methyl-N-(phenylmethyl)propan-1-amine; ethanedioic acid Openeye Name: N-benzyl-3-(2-chloro-5-methyl-phenoxy)-N-methyl-propan-1-amine; oxalic acid CAS Name: 3-(2-chloro-5-methylphenoxy)-N-methyl-N-(phenylmethyl)-1-propanamine; oxalic acid IUPAC Name: N-benzyl-3-(2-chloro-5-methylphenoxy)-N-methylpropan-1-amine; oxalic acid Traditional Name: benzyl-[3-(2-chloro-5-methyl-phenoxy)propyl]-methyl-amine; oxalic acid Formula: C20H24ClNO5 MolecularWeight: 393.86126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)Cl)OCCCN(C)CC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

CC1=CC(=C(C=C1)Cl)OCCCN(C)CC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H22ClNO.C2H2O4/c1-15-9-10-17(19)18(13-15)21-12-6-11-20(2)14-16-7-4-3-5-8-16;3-1(4)2(5)6/h3-5,7-10,13H,6,11-12,14H2,1-2H3;(H,3,4)(H,5,6)