dimethyl (2R,3R)-3-methyl-2-phenylselanyl-2-tetradecyl-butanedioate

Systemtic Name: dimethyl (2R,3R)-3-methyl-2-phenylselanyl-2-tetradecyl-butanedioate Openeye Name: dimethyl (2R,3R)-3-methyl-2-phenylselanyl-2-tetradecyl-butanedioate CAS Name: (2R,3R)-3-methyl-2-(phenylseleno)-2-tetradecylbutanedioic acid dimethyl ester IUPAC Name: dimethyl (2R,3R)-3-methyl-2-phenylselanyl-2-tetradecylbutanedioate Traditional Name: (2R,3R)-3-methyl-2-myristyl-2-(phenylseleno)succinic acid dimethyl ester Formula: C27H44O4Se MolecularWeight: 511.59586

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C)C(=O)OC)(C(=O)OC)[Se]C1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCC[C@@]([C@H](C)C(=O)OC)(C(=O)OC)[Se]C1=CC=CC=C1

InChI

InChI=1S/C27H44O4Se/c1-5-6-7-8-9-10-11-12-13-14-15-19-22-27(26(29)31-4,23(2)25(28)30-3)32-24-20-17-16-18-21-24/h16-18,20-21,23H,5-15,19,22H2,1-4H3/t23-,27-/m1/s1