(E)-16-(1,3-benzodioxol-5-yl)hexadec-15-en-2-one

Systemtic Name: (E)-16-(1,3-benzodioxol-5-yl)hexadec-15-en-2-one Openeye Name: (E)-16-(1,3-benzodioxol-5-yl)hexadec-15-en-2-one CAS Name: (E)-16-(1,3-benzodioxol-5-yl)-15-hexadecen-2-one IUPAC Name: (E)-16-(1,3-benzodioxol-5-yl)hexadec-15-en-2-one Traditional Name: (E)-16-(1,3-benzodioxol-5-yl)hexadec-15-en-2-one Formula: C23H34O3 MolecularWeight: 358.51426

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H34O3/c1-20(24)14-12-10-8-6-4-2-3-5-7-9-11-13-15-21-16-17-22-23(18-21)26-19-25-22/h13,15-18H,2-12,14,19H2,1H3/b15-13+