4-(4-hexadecylpiperazin-1-yl)benzaldehyde

Systemtic Name: 4-(4-hexadecylpiperazin-1-yl)benzaldehyde Openeye Name: 4-(4-hexadecylpiperazin-1-yl)benzaldehyde CAS Name: 4-(4-hexadecyl-1-piperazinyl)benzaldehyde IUPAC Name: 4-(4-hexadecylpiperazin-1-yl)benzaldehyde Traditional Name: 4-(4-cetylpiperazino)benzaldehyde Formula: C27H46N2O MolecularWeight: 414.66694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCN1CCN(CC1)C2=CC=C(C=C2)C=O

Isomeric SMILES

CCCCCCCCCCCCCCCCN1CCN(CC1)C2=CC=C(C=C2)C=O

InChI

InChI=1S/C27H46N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-28-21-23-29(24-22-28)27-18-16-26(25-30)17-19-27/h16-19,25H,2-15,20-24H2,1H3