(E)-N-[3-[2-(3-azanylpentan-3-yl)phenyl]propyl]-12-oxidanyl-octadec-9-enamide

Systemtic Name: (E)-N-[3-[2-(3-azanylpentan-3-yl)phenyl]propyl]-12-oxidanyl-octadec-9-enamide Openeye Name: (E)-N-[3-[2-(1-amino-1-ethyl-propyl)phenyl]propyl]-12-hydroxy-octadec-9-enamide CAS Name: (E)-N-[3-[2-(3-aminopentan-3-yl)phenyl]propyl]-12-hydroxy-9-octadecenamide IUPAC Name: (E)-N-[3-[2-(3-aminopentan-3-yl)phenyl]propyl]-12-hydroxyoctadec-9-enamide Traditional Name: (E)-N-[3-[2-(1-amino-1-ethyl-propyl)phenyl]propyl]-12-hydroxy-octadec-9-enamide Formula: C32H56N2O2 MolecularWeight: 500.79924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC=CCCCCCCCC(=O)NCCCC1=CC=CC=C1C(CC)(CC)N)O

Isomeric SMILES

CCCCCCC(C/C=C/CCCCCCCC(=O)NCCCC1=CC=CC=C1C(CC)(CC)N)O

InChI

InChI=1S/C32H56N2O2/c1-4-7-8-15-23-29(35)24-16-13-11-9-10-12-14-17-26-31(36)34-27-20-22-28-21-18-19-25-30(28)32(33,5-2)6-3/h13,16,18-19,21,25,29,35H,4-12,14-15,17,20,22-24,26-27,33H2,1-3H3,(H,34,36)/b16-13+