methyl 2-oxidanyl-6-tridecyl-benzoate

Systemtic Name: methyl 2-oxidanyl-6-tridecyl-benzoate Openeye Name: methyl 2-hydroxy-6-tridecyl-benzoate CAS Name: 2-hydroxy-6-tridecylbenzoic acid methyl ester IUPAC Name: methyl 2-hydroxy-6-tridecylbenzoate Traditional Name: 2-hydroxy-6-tridecyl-benzoic acid methyl ester Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC1=C(C(=CC=C1)O)C(=O)OC

Isomeric SMILES

CCCCCCCCCCCCCC1=C(C(=CC=C1)O)C(=O)OC

InChI

InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-15-18-16-14-17-19(22)20(18)21(23)24-2/h14,16-17,22H,3-13,15H2,1-2H3