(phenylmethyl) (4R)-2,2-dimethyl-4-[(E)-3-oxidanylidenehexadec-1-enyl]-1,3-oxazolidine-3-carboxylate

Systemtic Name: (phenylmethyl) (4R)-2,2-dimethyl-4-[(E)-3-oxidanylidenehexadec-1-enyl]-1,3-oxazolidine-3-carboxylate Openeye Name: benzyl (4R)-2,2-dimethyl-4-[(E)-3-oxohexadec-1-enyl]oxazolidine-3-carboxylate CAS Name: (4R)-2,2-dimethyl-4-[(E)-3-oxohexadec-1-enyl]-3-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4R)-2,2-dimethyl-4-[(E)-3-oxohexadec-1-enyl]-1,3-oxazolidine-3-carboxylate Traditional Name: (4R)-4-[(E)-3-ketohexadec-1-enyl]-2,2-dimethyl-oxazolidine-3-carboxylic acid benzyl ester Formula: C29H45NO4 MolecularWeight: 471.6719

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)C=CC1COC(N1C(=O)OCC2=CC=CC=C2)(C)C

Isomeric SMILES

CCCCCCCCCCCCCC(=O)/C=C/[C@@H]1COC(N1C(=O)OCC2=CC=CC=C2)(C)C

InChI

InChI=1S/C29H45NO4/c1-4-5-6-7-8-9-10-11-12-13-17-20-27(31)22-21-26-24-34-29(2,3)30(26)28(32)33-23-25-18-15-14-16-19-25/h14-16,18-19,21-22,26H,4-13,17,20,23-24H2,1-3H3/b22-21+/t26-/m1/s1