3-[4-(hexadecan-2-ylamino)phenyl]propanoyl chloride

Systemtic Name: 3-[4-(hexadecan-2-ylamino)phenyl]propanoyl chloride Openeye Name: 3-[4-(1-methylpentadecylamino)phenyl]propanoyl chloride CAS Name: 3-[4-(hexadecan-2-ylamino)phenyl]propanoyl chloride IUPAC Name: 3-[4-(hexadecan-2-ylamino)phenyl]propanoyl chloride Traditional Name: 3-[4-(1-methylpentadecylamino)phenyl]propionyl chloride Formula: C25H42ClNO MolecularWeight: 408.06008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C)NC1=CC=C(C=C1)CCC(=O)Cl

Isomeric SMILES

CCCCCCCCCCCCCCC(C)NC1=CC=C(C=C1)CCC(=O)Cl

InChI

InChI=1S/C25H42ClNO/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-22(2)27-24-19-16-23(17-20-24)18-21-25(26)28/h16-17,19-20,22,27H,3-15,18,21H2,1-2H3