[1-methoxy-1,5-bis(oxidanylidene)tridecan-6-yl] benzoate

Systemtic Name: [1-methoxy-1,5-bis(oxidanylidene)tridecan-6-yl] benzoate Openeye Name: 1-(5-methoxy-5-oxo-pentanoyl)octyl benzoate CAS Name: benzoic acid (1-methoxy-1,5-dioxotridecan-6-yl) ester IUPAC Name: (1-methoxy-1,5-dioxotridecan-6-yl) benzoate Traditional Name: benzoic acid 1-(5-keto-5-methoxy-pentanoyl)octyl ester Formula: C21H30O5 MolecularWeight: 362.4599

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C(=O)CCCC(=O)OC)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCCCCC(C(=O)CCCC(=O)OC)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C21H30O5/c1-3-4-5-6-10-15-19(18(22)14-11-16-20(23)25-2)26-21(24)17-12-8-7-9-13-17/h7-9,12-13,19H,3-6,10-11,14-16H2,1-2H3