N-ethylethanamine; (9Z,12Z)-octadeca-9,12-dienoic acid

Systemtic Name: N-ethylethanamine; (9Z,12Z)-octadeca-9,12-dienoic acid Openeye Name: N-ethylethanamine; (9Z,12Z)-octadeca-9,12-dienoic acid CAS Name: N-ethylethanamine; (9Z,12Z)-octadeca-9,12-dienoic acid IUPAC Name: N-ethylethanamine; (9Z,12Z)-octadeca-9,12-dienoic acid Traditional Name: diethylamine; (9Z,12Z)-octadeca-9,12-dienoic acid Formula: C22H43NO2 MolecularWeight: 353.58232

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCC(=O)O.CCNCC

Isomeric SMILES

CCCCC/C=C\C/C=C\CCCCCCCC(=O)O.CCNCC

InChI

InChI=1S/C18H32O2.C4H11N/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;1-3-5-4-2/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);5H,3-4H2,1-2H3/b7-6-,10-9-;