O1-methyl O3-(phenylmethyl) 2-(4-undecoxyphenyl)propanedioate

Systemtic Name: O1-methyl O3-(phenylmethyl) 2-(4-undecoxyphenyl)propanedioate Openeye Name: O1-benzyl O3-methyl 2-(4-undecoxyphenyl)propanedioate CAS Name: 2-(4-undecoxyphenyl)propanedioic acid O1-methyl ester O3-(phenylmethyl) ester IUPAC Name: 3-O-benzyl 1-O-methyl 2-(4-undecoxyphenyl)propanedioate Traditional Name: 2-(4-undecoxyphenyl)malonic acid O1-benzyl ester O3-methyl ester Formula: C28H38O5 MolecularWeight: 454.59832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCOC1=CC=C(C=C1)C(C(=O)OC)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCOC1=CC=C(C=C1)C(C(=O)OC)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C28H38O5/c1-3-4-5-6-7-8-9-10-14-21-32-25-19-17-24(18-20-25)26(27(29)31-2)28(30)33-22-23-15-12-11-13-16-23/h11-13,15-20,26H,3-10,14,21-22H2,1-2H3