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

Systemtic Name: (E)-N-[3-[2-(2-azanylpropan-2-yl)phenyl]propyl]-12-oxidanyl-octadec-9-enamide Openeye Name: (E)-N-[3-[2-(1-amino-1-methyl-ethyl)phenyl]propyl]-12-hydroxy-octadec-9-enamide CAS Name: (E)-N-[3-[2-(2-aminopropan-2-yl)phenyl]propyl]-12-hydroxy-9-octadecenamide IUPAC Name: (E)-N-[3-[2-(2-aminopropan-2-yl)phenyl]propyl]-12-hydroxyoctadec-9-enamide Traditional Name: (E)-N-[3-[2-(1-amino-1-methyl-ethyl)phenyl]propyl]-12-hydroxy-octadec-9-enamide Formula: C30H52N2O2 MolecularWeight: 472.74608

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H52N2O2/c1-4-5-6-13-21-27(33)22-14-11-9-7-8-10-12-15-24-29(34)32-25-18-20-26-19-16-17-23-28(26)30(2,3)31/h11,14,16-17,19,23,27,33H,4-10,12-13,15,18,20-22,24-25,31H2,1-3H3,(H,32,34)/b14-11+