2-octadecyl-1-phenyl-icosan-1-amine

Systemtic Name: 2-octadecyl-1-phenyl-icosan-1-amine Openeye Name: 2-octadecyl-1-phenyl-icosan-1-amine CAS Name: 2-octadecyl-1-phenyl-1-eicosanamine IUPAC Name: 2-octadecyl-1-phenylicosan-1-amine Traditional Name: (1-phenyl-2-stearyl-eicosyl)amine Formula: C44H83N MolecularWeight: 626.13652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC)C(C1=CC=CC=C1)N

Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC)C(C1=CC=CC=C1)N

InChI

InChI=1S/C44H83N/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-34-38-42(44(45)43-40-36-33-37-41-43)39-35-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h33,36-37,40-42,44H,3-32,34-35,38-39,45H2,1-2H3