2,2-dimethylpropyl (3R,5S,6R)-3,5,7-trimethyl-6-(phenylmethoxymethoxy)octanoate

Systemtic Name: 2,2-dimethylpropyl (3R,5S,6R)-3,5,7-trimethyl-6-(phenylmethoxymethoxy)octanoate Openeye Name: 2,2-dimethylpropyl (3R,5S,6R)-6-(benzyloxymethoxy)-3,5,7-trimethyl-octanoate CAS Name: (3R,5S,6R)-3,5,7-trimethyl-6-(phenylmethoxymethoxy)octanoic acid 2,2-dimethylpropyl ester IUPAC Name: 2,2-dimethylpropyl (3R,5S,6R)-3,5,7-trimethyl-6-(phenylmethoxymethoxy)octanoate Traditional Name: (3R,5S,6R)-6-(benzoxymethoxy)-3,5,7-trimethyl-caprylic acid neopentyl ester Formula: C24H40O4 MolecularWeight: 392.572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(C)CC(C)CC(=O)OCC(C)(C)C)OCOCC1=CC=CC=C1

Isomeric SMILES

C[C@H](C[C@H](C)[C@@H](C(C)C)OCOCC1=CC=CC=C1)CC(=O)OCC(C)(C)C

InChI

InChI=1S/C24H40O4/c1-18(2)23(28-17-26-15-21-11-9-8-10-12-21)20(4)13-19(3)14-22(25)27-16-24(5,6)7/h8-12,18-20,23H,13-17H2,1-7H3/t19-,20+,23-/m1/s1