(E)-N-methyl-N-[(E)-octadec-9-enyl]octadec-9-en-1-amine; octadecanoic acid

Systemtic Name: (E)-N-methyl-N-[(E)-octadec-9-enyl]octadec-9-en-1-amine; octadecanoic acid Openeye Name: (E)-N-methyl-N-[(E)-octadec-9-enyl]octadec-9-en-1-amine; stearic acid CAS Name: (E)-N-methyl-N-[(E)-octadec-9-enyl]-9-octadecen-1-amine; octadecanoic acid IUPAC Name: (E)-N-methyl-N-[(E)-octadec-9-enyl]octadec-9-en-1-amine; octadecanoic acid Traditional Name: methyl-bis[(E)-octadec-9-enyl]amine; stearic acid Formula: C55H109NO2 MolecularWeight: 816.45946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCCC=CCCCCCCCCN(C)CCCCCCCCC=CCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O.CCCCCCCC/C=C/CCCCCCCCN(CCCCCCCC/C=C/CCCCCCCC)C

InChI

InChI=1S/C37H73N.C18H36O2/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-36-38(3)37-35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h18-21H,4-17,22-37H2,1-3H3;2-17H2,1H3,(H,19,20)/b20-18+,21-19+;