3-ethylpentan-2-yl 4-[4-(4-decoxyphenyl)phenyl]carbonyloxy-3-methyl-benzoate

Systemtic Name: 3-ethylpentan-2-yl 4-[4-(4-decoxyphenyl)phenyl]carbonyloxy-3-methyl-benzoate Openeye Name: (2-ethyl-1-methyl-butyl) 4-[4-(4-decoxyphenyl)benzoyl]oxy-3-methyl-benzoate CAS Name: 4-[[4-(4-decoxyphenyl)phenyl]-oxomethoxy]-3-methylbenzoic acid 3-ethylpentan-2-yl ester IUPAC Name: 3-ethylpentan-2-yl 4-[4-(4-decoxyphenyl)benzoyl]oxy-3-methylbenzoate Traditional Name: 4-[4-(4-decoxyphenyl)benzoyl]oxy-3-methyl-benzoic acid (2-ethyl-1-methyl-butyl) ester Formula: C38H50O5 MolecularWeight: 586.8006

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C38H50O5/c1-6-9-10-11-12-13-14-15-26-41-35-23-20-32(21-24-35)31-16-18-33(19-17-31)37(39)43-36-25-22-34(27-28(36)4)38(40)42-29(5)30(7-2)8-3/h16-25,27,29-30H,6-15,26H2,1-5H3