4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzaldehyde

Systemtic Name: 4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzaldehyde Openeye Name: 4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzaldehyde CAS Name: 4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzaldehyde IUPAC Name: 4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzaldehyde Traditional Name: 4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzaldehyde Formula: C31H42ClNO MolecularWeight: 480.12428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=O)NCCCCCCCCCCCCCCCCC#CC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CC(=CC=C1C=O)NCCCCCCCCCCCCCCCCC#CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C31H42ClNO/c32-30-22-18-28(19-23-30)17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-26-33-31-24-20-29(27-34)21-25-31/h18-25,27,33H,1-14,16,26H2