hexadecan-2-one; (E)-18-oxidanylidenenonadec-2-enamide

Systemtic Name: hexadecan-2-one; (E)-18-oxidanylidenenonadec-2-enamide Openeye Name: hexadecan-2-one; (E)-18-oxononadec-2-enamide CAS Name: 2-hexadecanone; (E)-18-oxo-2-nonadecenamide IUPAC Name: hexadecan-2-one; (E)-18-oxononadec-2-enamide Traditional Name: hexadecan-2-one; (E)-18-ketononadec-2-enamide Formula: C35H67NO3 MolecularWeight: 549.91138

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(=O)C.CC(=O)CCCCCCCCCCCCCCC=CC(=O)N

Isomeric SMILES

CCCCCCCCCCCCCCC(=O)C.CC(=O)CCCCCCCCCCCCCC/C=C/C(=O)N

InChI

InChI=1S/C19H35NO2.C16H32O/c1-18(21)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-19(20)22;1-3-4-5-6-7-8-9-10-11-12-13-14-15-16(2)17/h15,17H,2-14,16H2,1H3,(H2,20,22);3-15H2,1-2H3/b17-15+;