N1,N4-bis(1-cyclohexylethyl)cyclohexane-1,4-diamine; ethanoic acid

Systemtic Name: N1,N4-bis(1-cyclohexylethyl)cyclohexane-1,4-diamine; ethanoic acid Openeye Name: acetic acid; N1,N4-bis(1-cyclohexylethyl)cyclohexane-1,4-diamine CAS Name: acetic acid; N1,N4-bis(1-cyclohexylethyl)cyclohexane-1,4-diamine IUPAC Name: acetic acid; 1-N,4-N-bis(1-cyclohexylethyl)cyclohexane-1,4-diamine Traditional Name: acetic acid; 1-cyclohexylethyl-[4-(1-cyclohexylethylamino)cyclohexyl]amine Formula: C26H50N2O4 MolecularWeight: 454.6862

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCCCC1)NC2CCC(CC2)NC(C)C3CCCCC3.CC(=O)O.CC(=O)O

Isomeric SMILES

CC(C1CCCCC1)NC2CCC(CC2)NC(C)C3CCCCC3.CC(=O)O.CC(=O)O

InChI

InChI=1S/C22H42N2.2C2H4O2/c1-17(19-9-5-3-6-10-19)23-21-13-15-22(16-14-21)24-18(2)20-11-7-4-8-12-20;2*1-2(3)4/h17-24H,3-16H2,1-2H3;2*1H3,(H,3,4)