[2-(4-decoxyphenyl)phenyl] 4-[3-[(2S)-butan-2-yl]oxypropyl]benzoate

Systemtic Name: [2-(4-decoxyphenyl)phenyl] 4-[3-[(2S)-butan-2-yl]oxypropyl]benzoate Openeye Name: [2-(4-decoxyphenyl)phenyl] 4-[3-[(1S)-1-methylpropoxy]propyl]benzoate CAS Name: 4-[3-[(2S)-butan-2-yl]oxypropyl]benzoic acid [2-(4-decoxyphenyl)phenyl] ester IUPAC Name: [2-(4-decoxyphenyl)phenyl] 4-[3-[(2S)-butan-2-yl]oxypropyl]benzoate Traditional Name: 4-[3-[(1S)-1-methylpropoxy]propyl]benzoic acid [2-(4-decoxyphenyl)phenyl] ester Formula: C36H48O4 MolecularWeight: 544.76392

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=CC=C2OC(=O)C3=CC=C(C=C3)CCCOC(C)CC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=CC=C2OC(=O)C3=CC=C(C=C3)CCCO[C@@H](C)CC

InChI

InChI=1S/C36H48O4/c1-4-6-7-8-9-10-11-14-27-39-33-25-23-31(24-26-33)34-17-12-13-18-35(34)40-36(37)32-21-19-30(20-22-32)16-15-28-38-29(3)5-2/h12-13,17-26,29H,4-11,14-16,27-28H2,1-3H3/t29-/m0/s1