(E)-3-(4,5-dihydro-1H-imidazol-2-yl)nonadec-4-en-2-amine; ethanoic acid

Systemtic Name: (E)-3-(4,5-dihydro-1H-imidazol-2-yl)nonadec-4-en-2-amine; ethanoic acid Openeye Name: acetic acid; (E)-3-(4,5-dihydro-1H-imidazol-2-yl)nonadec-4-en-2-amine CAS Name: acetic acid; (E)-3-(4,5-dihydro-1H-imidazol-2-yl)-4-nonadecen-2-amine IUPAC Name: acetic acid; (E)-3-(4,5-dihydro-1H-imidazol-2-yl)nonadec-4-en-2-amine Traditional Name: acetic acid; [(E)-2-(2-imidazolin-2-yl)-1-methyl-octadec-3-enyl]amine Formula: C24H47N3O2 MolecularWeight: 409.64888

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC=CC(C1=NCCN1)C(C)N.CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC/C=C/C(C1=NCCN1)C(C)N.CC(=O)O

InChI

InChI=1S/C22H43N3.C2H4O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21(20(2)23)22-24-18-19-25-22;1-2(3)4/h16-17,20-21H,3-15,18-19,23H2,1-2H3,(H,24,25);1H3,(H,3,4)/b17-16+;