[4-[(2S)-2-methylbutanoyl]oxyphenyl] 4-decoxybenzoate

Systemtic Name: [4-[(2S)-2-methylbutanoyl]oxyphenyl] 4-decoxybenzoate Openeye Name: [4-[(2S)-2-methylbutanoyl]oxyphenyl] 4-decoxybenzoate CAS Name: 4-decoxybenzoic acid [4-[(2S)-2-methyl-1-oxobutoxy]phenyl] ester IUPAC Name: [4-[(2S)-2-methylbutanoyl]oxyphenyl] 4-decoxybenzoate Traditional Name: 4-decoxybenzoic acid [4-[(2S)-2-methylbutanoyl]oxyphenyl] ester Formula: C28H38O5 MolecularWeight: 454.59832

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC(=O)C(C)CC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC(=O)[C@@H](C)CC

InChI

InChI=1S/C28H38O5/c1-4-6-7-8-9-10-11-12-21-31-24-15-13-23(14-16-24)28(30)33-26-19-17-25(18-20-26)32-27(29)22(3)5-2/h13-20,22H,4-12,21H2,1-3H3/t22-/m0/s1