2-tridecan-6-yloxycarbonylbenzoate

Systemtic Name: 2-tridecan-6-yloxycarbonylbenzoate Openeye Name: 2-(1-pentyloctoxycarbonyl)benzoate CAS Name: 2-[oxo(tridecan-6-yloxy)methyl]benzoate IUPAC Name: 2-tridecan-6-yloxycarbonylbenzoate Traditional Name: 2-(1-amyloctoxycarbonyl)benzoate Formula: C21H31O4- MolecularWeight: 347.46844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H32O4/c1-3-5-7-8-10-14-17(13-9-6-4-2)25-21(24)19-16-12-11-15-18(19)20(22)23/h11-12,15-17H,3-10,13-14H2,1-2H3,(H,22,23)/p-1