1-oxidanyl-1-oxidanylidene-12-phenylmethoxy-8-(1-phenylmethoxypropyl)heptadecan-8-olate

Systemtic Name: 1-oxidanyl-1-oxidanylidene-12-phenylmethoxy-8-(1-phenylmethoxypropyl)heptadecan-8-olate Openeye Name: 12-benzyloxy-8-(1-benzyloxypropyl)-1-hydroxy-1-oxo-heptadecan-8-olate CAS Name: 1-hydroxy-1-oxo-12-phenylmethoxy-8-(1-phenylmethoxypropyl)-8-heptadecanolate IUPAC Name: 1-hydroxy-1-oxo-12-phenylmethoxy-8-(1-phenylmethoxypropyl)heptadecan-8-olate Traditional Name: 12-benzoxy-8-(1-benzoxypropyl)-1-hydroxy-1-keto-heptadecan-8-olate Formula: C34H51O5- MolecularWeight: 539.76574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CCCC(CCCCCCC(=O)O)(C(CC)OCC1=CC=CC=C1)[O-])OCC2=CC=CC=C2

Isomeric SMILES

CCCCCC(CCCC(CCCCCCC(=O)O)(C(CC)OCC1=CC=CC=C1)[O-])OCC2=CC=CC=C2

InChI

InChI=1S/C34H51O5/c1-3-5-10-22-31(38-27-29-18-11-8-12-19-29)23-17-26-34(37,25-16-7-6-15-24-33(35)36)32(4-2)39-28-30-20-13-9-14-21-30/h8-9,11-14,18-21,31-32H,3-7,10,15-17,22-28H2,1-2H3,(H,35,36)/q-1