hexadecanoic acid; N-octyl-1-[10-(4-octyliminopyridin-1-yl)decyl]pyridin-4-imine

Systemtic Name: hexadecanoic acid; N-octyl-1-[10-(4-octyliminopyridin-1-yl)decyl]pyridin-4-imine Openeye Name: N-octyl-1-[10-(4-octylimino-1-pyridyl)decyl]pyridin-4-imine; palmitic acid CAS Name: hexadecanoic acid; N-octyl-1-[10-(4-octylimino-1-pyridinyl)decyl]-4-pyridinimine IUPAC Name: hexadecanoic acid; N-octyl-1-[10-(4-octyliminopyridin-1-yl)decyl]pyridin-4-imine Traditional Name: octyl-[1-[10-(4-octylimino-1-pyridyl)decyl]-4-pyridylidene]amine; palmitic acid Formula: C52H94N4O2 MolecularWeight: 807.32836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)O.CCCCCCCCN=C1C=CN(C=C1)CCCCCCCCCCN2C=CC(=NCCCCCCCC)C=C2

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)O.CCCCCCCCN=C1C=CN(C=C1)CCCCCCCCCCN2C=CC(=NCCCCCCCC)C=C2

InChI

InChI=1S/C36H62N4.C16H32O2/c1-3-5-7-9-15-19-27-37-35-23-31-39(32-24-35)29-21-17-13-11-12-14-18-22-30-40-33-25-36(26-34-40)38-28-20-16-10-8-6-4-2;1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h23-26,31-34H,3-22,27-30H2,1-2H3;2-15H2,1H3,(H,17,18)