[4-[(2S)-1-ethoxypropan-2-yl]oxycarbonylphenyl] 4-(4-decoxyphenyl)benzoate

Systemtic Name: [4-[(2S)-1-ethoxypropan-2-yl]oxycarbonylphenyl] 4-(4-decoxyphenyl)benzoate Openeye Name: [4-[(1S)-2-ethoxy-1-methyl-ethoxy]carbonylphenyl] 4-(4-decoxyphenyl)benzoate CAS Name: 4-(4-decoxyphenyl)benzoic acid [4-[[(2S)-1-ethoxypropan-2-yl]oxy-oxomethyl]phenyl] ester IUPAC Name: [4-[(2S)-1-ethoxypropan-2-yl]oxycarbonylphenyl] 4-(4-decoxyphenyl)benzoate Traditional Name: 4-(4-decoxyphenyl)benzoic acid [4-[(1S)-2-ethoxy-1-methyl-ethoxy]carbonylphenyl] ester Formula: C35H44O6 MolecularWeight: 560.72026

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)OC(C)COCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(=O)O[C@@H](C)COCC

InChI

InChI=1S/C35H44O6/c1-4-6-7-8-9-10-11-12-25-39-32-21-17-29(18-22-32)28-13-15-30(16-14-28)35(37)41-33-23-19-31(20-24-33)34(36)40-27(3)26-38-5-2/h13-24,27H,4-12,25-26H2,1-3H3/t27-/m0/s1