octadecan-1-amine; 2,4,6-tris(chloranyl)phenol

Systemtic Name: octadecan-1-amine; 2,4,6-tris(chloranyl)phenol Openeye Name: octadecan-1-amine; 2,4,6-trichlorophenol CAS Name: 1-octadecanamine; 2,4,6-trichlorophenol IUPAC Name: octadecan-1-amine; 2,4,6-trichlorophenol Traditional Name: stearylamine; 2,4,6-trichlorophenol Formula: C24H42Cl3NO MolecularWeight: 466.95538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCN.C1=C(C=C(C(=C1Cl)O)Cl)Cl

Isomeric SMILES

CCCCCCCCCCCCCCCCCCN.C1=C(C=C(C(=C1Cl)O)Cl)Cl

InChI

InChI=1S/C18H39N.C6H3Cl3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19;7-3-1-4(8)6(10)5(9)2-3/h2-19H2,1H3;1-2,10H