(9-methoxycarbonyl-6-oxidanyl-pentadecan-8-yl) benzoate

Systemtic Name: (9-methoxycarbonyl-6-oxidanyl-pentadecan-8-yl) benzoate Openeye Name: [1-(2-hydroxyheptyl)-2-methoxycarbonyl-octyl] benzoate CAS Name: benzoic acid (6-hydroxy-9-methoxycarbonylpentadecan-8-yl) ester IUPAC Name: (6-hydroxy-9-methoxycarbonylpentadecan-8-yl) benzoate Traditional Name: benzoic acid [2-carbomethoxy-1-(2-hydroxyheptyl)octyl] ester Formula: C24H38O5 MolecularWeight: 406.55552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(CC(CCCCC)O)OC(=O)C1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCCCCCC(C(CC(CCCCC)O)OC(=O)C1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C24H38O5/c1-4-6-8-13-17-21(24(27)28-3)22(18-20(25)16-10-7-5-2)29-23(26)19-14-11-9-12-15-19/h9,11-12,14-15,20-22,25H,4-8,10,13,16-18H2,1-3H3