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2-hydroxyethyl-methyl-bis[(E)-octadec-9-enoyl]azanium

2-hydroxyethyl-methyl-bis[(E)-octadec-9-enoyl]azanium

Systemtic Name:2-hydroxyethyl-methyl-bis[(E)-octadec-9-enoyl]azanium
Openeye Name:2-hydroxyethyl-methyl-bis[(E)-octadec-9-enoyl]ammonium
CAS Name:2-hydroxyethyl-methyl-bis[(E)-1-oxooctadec-9-enyl]ammonium
IUPAC Name:2-hydroxyethyl-methyl-bis[(E)-octadec-9-enoyl]azanium
Traditional Name:2-hydroxyethyl-methyl-bis[(E)-octadec-9-enoyl]ammonium
Formula: C39H74NO3+
MolecularWeight: 605.00976
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)[N+](C)(CCO)C(=O)CCCCCCCC=CCCCCCCCC


Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)[N+](C(=O)CCCCCCC/C=C/CCCCCCCC)(CCO)C


InChI

InChI=1S/C39H74NO3/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-38(42)40(3,36-37-41)39(43)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h18-21,41H,4-17,22-37H2,1-3H3/q+1/b20-18+,21-19+


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