2-heptadecan-9-yloxycarbonylbenzoate

Systemtic Name: 2-heptadecan-9-yloxycarbonylbenzoate Openeye Name: 2-(1-octylnonoxycarbonyl)benzoate CAS Name: 2-[heptadecan-9-yloxy(oxo)methyl]benzoate IUPAC Name: 2-heptadecan-9-yloxycarbonylbenzoate Traditional Name: 2-(1-octylnonoxycarbonyl)benzoate Formula: C25H39O4- MolecularWeight: 403.57476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CCCCCCCC)OC(=O)C1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CCCCCCCCC(CCCCCCCC)OC(=O)C1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C25H40O4/c1-3-5-7-9-11-13-17-21(18-14-12-10-8-6-4-2)29-25(28)23-20-16-15-19-22(23)24(26)27/h15-16,19-21H,3-14,17-18H2,1-2H3,(H,26,27)/p-1