(3-methoxycarbonyl-6-oxidanyl-tricosan-4-yl) benzoate

Systemtic Name: (3-methoxycarbonyl-6-oxidanyl-tricosan-4-yl) benzoate Openeye Name: [3-hydroxy-1-(1-methoxycarbonylpropyl)icosyl] benzoate CAS Name: benzoic acid (6-hydroxy-3-methoxycarbonyltricosan-4-yl) ester IUPAC Name: (6-hydroxy-3-methoxycarbonyltricosan-4-yl) benzoate Traditional Name: benzoic acid [1-(1-carbomethoxypropyl)-3-hydroxy-eicosyl] ester Formula: C32H54O5 MolecularWeight: 518.76816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C32H54O5/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-18-22-25-28(33)26-30(29(5-2)32(35)36-3)37-31(34)27-23-20-19-21-24-27/h19-21,23-24,28-30,33H,4-18,22,25-26H2,1-3H3