N-methyl-1-[(9Z,12Z)-octadeca-9,12-dienoxy]-3-[(9E,12E)-octadeca-9,12-dienoxy]-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine

Systemtic Name: N-methyl-1-[(9Z,12Z)-octadeca-9,12-dienoxy]-3-[(9E,12E)-octadeca-9,12-dienoxy]-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine Openeye Name: N-methyl-1-[(9Z,12Z)-octadeca-9,12-dienoxy]-3-[(9E,12E)-octadeca-9,12-dienoxy]-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine CAS Name: N-methyl-1-[(9Z,12Z)-octadeca-9,12-dienoxy]-3-[(9E,12E)-octadeca-9,12-dienoxy]-N-[3-(1-pyrrolidinyl)propyl]-2-propanamine IUPAC Name: N-methyl-1-[(9Z,12Z)-octadeca-9,12-dienoxy]-3-[(9E,12E)-octadeca-9,12-dienoxy]-N-(3-pyrrolidin-1-ylpropyl)propan-2-amine Traditional Name: methyl-[2-[(9Z,12Z)-octadeca-9,12-dienoxy]-1-[[(9E,12E)-octadeca-9,12-dienoxy]methyl]ethyl]-(3-pyrrolidinopropyl)amine Formula: C47H88N2O2 MolecularWeight: 713.21382

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCCOCC(COCCCCCCCCC=CCC=CCCCCC)N(C)CCCN1CCCC1

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCCOCC(COCCCCCCCC/C=C\C/C=C\CCCCC)N(C)CCCN1CCCC1

InChI

InChI=1S/C47H88N2O2/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-36-43-50-45-47(48(3)39-38-42-49-40-34-35-41-49)46-51-44-37-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h12-15,18-21,47H,4-11,16-17,22-46H2,1-3H3/b14-12-,15-13+,20-18-,21-19+