ethoxycarbonyl (E)-13-(1,3-benzodioxol-5-yl)tridec-12-enoate

Systemtic Name: ethoxycarbonyl (E)-13-(1,3-benzodioxol-5-yl)tridec-12-enoate Openeye Name: ethoxycarbonyl (E)-13-(1,3-benzodioxol-5-yl)tridec-12-enoate CAS Name: (E)-13-(1,3-benzodioxol-5-yl)-12-tridecenoic acid ethoxycarbonyl ester IUPAC Name: ethoxycarbonyl (E)-13-(1,3-benzodioxol-5-yl)tridec-12-enoate Traditional Name: (E)-13-(1,3-benzodioxol-5-yl)tridec-12-enoic acid carbethoxy ester Formula: C23H32O6 MolecularWeight: 404.49658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)OC(=O)CCCCCCCCCCC=CC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCOC(=O)OC(=O)CCCCCCCCCC/C=C/C1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C23H32O6/c1-2-26-23(25)29-22(24)14-12-10-8-6-4-3-5-7-9-11-13-19-15-16-20-21(17-19)28-18-27-20/h11,13,15-17H,2-10,12,14,18H2,1H3/b13-11+