N-[[4-[(cyclohexylamino)methyl]cyclohex-3-en-1-yl]methyl]cyclohexanamine; ethanoic acid

Systemtic Name: N-[[4-[(cyclohexylamino)methyl]cyclohex-3-en-1-yl]methyl]cyclohexanamine; ethanoic acid Openeye Name: acetic acid; N-[[4-[(cyclohexylamino)methyl]cyclohex-3-en-1-yl]methyl]cyclohexanamine CAS Name: acetic acid; N-[[4-[(cyclohexylamino)methyl]-1-cyclohex-3-enyl]methyl]cyclohexanamine IUPAC Name: acetic acid; N-[[4-[(cyclohexylamino)methyl]cyclohex-3-en-1-yl]methyl]cyclohexanamine Traditional Name: acetic acid; cyclohexyl-[[4-[(cyclohexylamino)methyl]cyclohexen-1-yl]methyl]amine Formula: C24H44N2O4 MolecularWeight: 424.61716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)O.CC(=O)O.C1CCC(CC1)NCC2CCC(=CC2)CNC3CCCCC3

Isomeric SMILES

CC(=O)O.CC(=O)O.C1CCC(CC1)NCC2CCC(=CC2)CNC3CCCCC3

InChI

InChI=1S/C20H36N2.2C2H4O2/c1-3-7-19(8-4-1)21-15-17-11-13-18(14-12-17)16-22-20-9-5-2-6-10-20;2*1-2(3)4/h11,18-22H,1-10,12-16H2;2*1H3,(H,3,4)