(E)-18-(1,3-benzodioxol-5-yl)octadec-17-en-2-one

Systemtic Name: (E)-18-(1,3-benzodioxol-5-yl)octadec-17-en-2-one Openeye Name: (E)-18-(1,3-benzodioxol-5-yl)octadec-17-en-2-one CAS Name: (E)-18-(1,3-benzodioxol-5-yl)-17-octadecen-2-one IUPAC Name: (E)-18-(1,3-benzodioxol-5-yl)octadec-17-en-2-one Traditional Name: (E)-18-(1,3-benzodioxol-5-yl)octadec-17-en-2-one Formula: C25H38O3 MolecularWeight: 386.56742

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCCCCCCCCCCCCCC=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CC(=O)CCCCCCCCCCCCCC/C=C/C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C25H38O3/c1-22(26)16-14-12-10-8-6-4-2-3-5-7-9-11-13-15-17-23-18-19-24-25(20-23)28-21-27-24/h15,17-20H,2-14,16,21H2,1H3/b17-15+