N-[4-(4-chloranylphenoxy)butyl]-2,3-dimethyl-cyclohexan-1-amine; ethanedioic acid

Systemtic Name: N-[4-(4-chloranylphenoxy)butyl]-2,3-dimethyl-cyclohexan-1-amine; ethanedioic acid Openeye Name: N-[4-(4-chlorophenoxy)butyl]-2,3-dimethyl-cyclohexanamine; oxalic acid CAS Name: N-[4-(4-chlorophenoxy)butyl]-2,3-dimethyl-1-cyclohexanamine; oxalic acid IUPAC Name: N-[4-(4-chlorophenoxy)butyl]-2,3-dimethylcyclohexan-1-amine; oxalic acid Traditional Name: 4-(4-chlorophenoxy)butyl-(2,3-dimethylcyclohexyl)amine; oxalic acid Formula: C20H30ClNO5 MolecularWeight: 399.9089

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NCCCCOC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CC1CCCC(C1C)NCCCCOC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H28ClNO.C2H2O4/c1-14-6-5-7-18(15(14)2)20-12-3-4-13-21-17-10-8-16(19)9-11-17;3-1(4)2(5)6/h8-11,14-15,18,20H,3-7,12-13H2,1-2H3;(H,3,4)(H,5,6)