N1,N4-bis[(2-chlorophenyl)methyl]cyclohexane-1,4-diamine; ethanoic acid

Systemtic Name: N1,N4-bis[(2-chlorophenyl)methyl]cyclohexane-1,4-diamine; ethanoic acid Openeye Name: acetic acid; N1,N4-bis[(2-chlorophenyl)methyl]cyclohexane-1,4-diamine CAS Name: acetic acid; N1,N4-bis[(2-chlorophenyl)methyl]cyclohexane-1,4-diamine IUPAC Name: acetic acid; 1-N,4-N-bis[(2-chlorophenyl)methyl]cyclohexane-1,4-diamine Traditional Name: acetic acid; (2-chlorobenzyl)-[4-[(2-chlorobenzyl)amino]cyclohexyl]amine Formula: C24H32Cl2N2O4 MolecularWeight: 483.42788

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(=O)O.C1CC(CCC1NCC2=CC=CC=C2Cl)NCC3=CC=CC=C3Cl

Isomeric SMILES

CC(=O)O.CC(=O)O.C1CC(CCC1NCC2=CC=CC=C2Cl)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C20H24Cl2N2.2C2H4O2/c21-19-7-3-1-5-15(19)13-23-17-9-11-18(12-10-17)24-14-16-6-2-4-8-20(16)22;2*1-2(3)4/h1-8,17-18,23-24H,9-14H2;2*1H3,(H,3,4)