[4-(2,3-dihexadecoxypropoxy)phenyl]methanamine

Systemtic Name: [4-(2,3-dihexadecoxypropoxy)phenyl]methanamine Openeye Name: [4-(2,3-dihexadecoxypropoxy)phenyl]methanamine CAS Name: [4-(2,3-dihexadecoxypropoxy)phenyl]methanamine IUPAC Name: [4-(2,3-dihexadecoxypropoxy)phenyl]methanamine Traditional Name: [4-(2,3-dicetyloxypropoxy)benzyl]amine Formula: C42H79NO3 MolecularWeight: 646.08156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(COC1=CC=C(C=C1)CN)OCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(COC1=CC=C(C=C1)CN)OCCCCCCCCCCCCCCCC

InChI

InChI=1S/C42H79NO3/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-35-44-38-42(39-46-41-33-31-40(37-43)32-34-41)45-36-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h31-34,42H,3-30,35-39,43H2,1-2H3