1-[3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butyl]-N,N-dimethyl-pyrrolidin-3-amine

Systemtic Name: 1-[3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butyl]-N,N-dimethyl-pyrrolidin-3-amine Openeye Name: 1-[3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butyl]-N,N-dimethyl-pyrrolidin-3-amine CAS Name: 1-[3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butyl]-N,N-dimethyl-3-pyrrolidinamine IUPAC Name: 1-[3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butyl]-N,N-dimethylpyrrolidin-3-amine Traditional Name: [1-[3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butyl]pyrrolidin-3-yl]-dimethyl-amine Formula: C46H86N2O2 MolecularWeight: 699.18724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCCOCC(CCN1CCC(C1)N(C)C)OCCCCCCCCC=CCC=CCCCCC

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCCOCC(CCN1CCC(C1)N(C)C)OCCCCCCCC/C=C/C/C=C/CCCCC

InChI

InChI=1S/C46H86N2O2/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-41-49-44-46(38-40-48-39-37-45(43-48)47(3)4)50-42-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h13-16,19-22,45-46H,5-12,17-18,23-44H2,1-4H3/b15-13+,16-14+,21-19+,22-20+