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

Systemtic Name: N,N-dimethyl-3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butan-1-amine Openeye Name: N,N-dimethyl-3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butan-1-amine CAS Name: N,N-dimethyl-3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]-1-butanamine IUPAC Name: N,N-dimethyl-3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butan-1-amine Traditional Name: 3,4-bis[(9E,12E)-octadeca-9,12-dienoxy]butyl-dimethyl-amine Formula: C42H79NO2 MolecularWeight: 630.08216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC=CCCCCCCCCOCC(CCN(C)C)OCCCCCCCCC=CCC=CCCCCC

Isomeric SMILES

CCCCC/C=C/C/C=C/CCCCCCCCOCC(CCN(C)C)OCCCCCCCC/C=C/C/C=C/CCCCC

InChI

InChI=1S/C42H79NO2/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-44-41-42(37-38-43(3)4)45-40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h13-16,19-22,42H,5-12,17-18,23-41H2,1-4H3/b15-13+,16-14+,21-19+,22-20+