(E)-1-(4-methyl-1,3-benzoxazol-2-yl)octadec-9-en-1-one

Systemtic Name: (E)-1-(4-methyl-1,3-benzoxazol-2-yl)octadec-9-en-1-one Openeye Name: (E)-1-(4-methyl-1,3-benzoxazol-2-yl)octadec-9-en-1-one CAS Name: (E)-1-(4-methyl-1,3-benzoxazol-2-yl)-9-octadecen-1-one IUPAC Name: (E)-1-(4-methyl-1,3-benzoxazol-2-yl)octadec-9-en-1-one Traditional Name: (E)-1-(4-methyl-1,3-benzoxazol-2-yl)octadec-9-en-1-one Formula: C26H39NO2 MolecularWeight: 397.59336

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C1=NC2=C(C=CC=C2O1)C

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C1=NC2=C(C=CC=C2O1)C

InChI

InChI=1S/C26H39NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20-23(28)26-27-25-22(2)19-18-21-24(25)29-26/h10-11,18-19,21H,3-9,12-17,20H2,1-2H3/b11-10+