(E)-octadec-9-enoic acid; 1-(2-pentadecyl-4,5-dihydroimidazol-1-yl)ethanamine

Systemtic Name: (E)-octadec-9-enoic acid; 1-(2-pentadecyl-4,5-dihydroimidazol-1-yl)ethanamine Openeye Name: (E)-octadec-9-enoic acid; 1-(2-pentadecyl-4,5-dihydroimidazol-1-yl)ethanamine CAS Name: (E)-9-octadecenoic acid; 1-(2-pentadecyl-4,5-dihydroimidazol-1-yl)ethanamine IUPAC Name: (E)-octadec-9-enoic acid; 1-(2-pentadecyl-4,5-dihydroimidazol-1-yl)ethanamine Traditional Name: elaidic acid; 1-(2-pentadecyl-2-imidazolin-1-yl)ethylamine Formula: C38H75N3O2 MolecularWeight: 606.021

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC1=NCCN1C(C)N.CCCCCCCCC=CCCCCCCCC(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC1=NCCN1C(C)N.CCCCCCCC/C=C/CCCCCCCC(=O)O

InChI

InChI=1S/C20H41N3.C18H34O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-22-17-18-23(20)19(2)21;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h19H,3-18,21H2,1-2H3;9-10H,2-8,11-17H2,1H3,(H,19,20)/b;10-9+