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

Systemtic Name: (9-methoxycarbonyl-6-phenylmethoxy-pentadecan-8-yl) benzoate Openeye Name: [1-(2-benzyloxyheptyl)-2-methoxycarbonyl-octyl] benzoate CAS Name: benzoic acid (9-methoxycarbonyl-6-phenylmethoxypentadecan-8-yl) ester IUPAC Name: (9-methoxycarbonyl-6-phenylmethoxypentadecan-8-yl) benzoate Traditional Name: benzoic acid [1-(2-benzoxyheptyl)-2-carbomethoxy-octyl] ester Formula: C31H44O5 MolecularWeight: 496.67806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(CC(CCCCC)OCC1=CC=CC=C1)OC(=O)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCCCCCC(C(CC(CCCCC)OCC1=CC=CC=C1)OC(=O)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C31H44O5/c1-4-6-8-16-22-28(31(33)34-3)29(36-30(32)26-19-14-10-15-20-26)23-27(21-11-7-5-2)35-24-25-17-12-9-13-18-25/h9-10,12-15,17-20,27-29H,4-8,11,16,21-24H2,1-3H3