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

Systemtic Name: 1-[(9Z,12Z)-octadeca-9,12-dienoxy]-3-[(9E,12E)-octadeca-9,12-dienoxy]-N-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]propan-2-amine Openeye Name: 1-[(9Z,12Z)-octadeca-9,12-dienoxy]-3-[(9E,12E)-octadeca-9,12-dienoxy]-N-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]propan-2-amine CAS Name: 1-[(9Z,12Z)-octadeca-9,12-dienoxy]-3-[(9E,12E)-octadeca-9,12-dienoxy]-N-[[3-(1-pyrrolidinylmethyl)phenyl]methyl]-2-propanamine IUPAC Name: 1-[(9Z,12Z)-octadeca-9,12-dienoxy]-3-[(9E,12E)-octadeca-9,12-dienoxy]-N-[[3-(pyrrolidin-1-ylmethyl)phenyl]methyl]propan-2-amine Traditional Name: [2-[(9Z,12Z)-octadeca-9,12-dienoxy]-1-[[(9E,12E)-octadeca-9,12-dienoxy]methyl]ethyl]-[3-(pyrrolidinomethyl)benzyl]amine Formula: C51H88N2O2 MolecularWeight: 761.25662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCCOCC(COCCCCCCCCC=CCC=CCCCCC)NCC1=CC=CC(=C1)CN2CCCC2

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCCOCC(COCCCCCCCC/C=C\C/C=C\CCCCC)NCC1=CC=CC(=C1)CN2CCCC2

InChI

InChI=1S/C51H88N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-35-42-54-47-51(52-45-49-38-37-39-50(44-49)46-53-40-33-34-41-53)48-55-43-36-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,37-39,44,51-52H,3-10,15-16,21-36,40-43,45-48H2,1-2H3/b13-11-,14-12+,19-17-,20-18+