propyl 2,6-dimethyl-4-[2,2,2-tris(3,5-dimethyl-4-propoxycarbonyl-phenyl)ethyl]benzoate

Systemtic Name: propyl 2,6-dimethyl-4-[2,2,2-tris(3,5-dimethyl-4-propoxycarbonyl-phenyl)ethyl]benzoate Openeye Name: propyl 2,6-dimethyl-4-[2,2,2-tris(3,5-dimethyl-4-propoxycarbonyl-phenyl)ethyl]benzoate CAS Name: 2,6-dimethyl-4-[2,2,2-tris[3,5-dimethyl-4-[oxo(propoxy)methyl]phenyl]ethyl]benzoic acid propyl ester IUPAC Name: propyl 2,6-dimethyl-4-[2,2,2-tris(3,5-dimethyl-4-propoxycarbonylphenyl)ethyl]benzoate Traditional Name: 2,6-dimethyl-4-[2,2,2-tris(3,5-dimethyl-4-propoxycarbonyl-phenyl)ethyl]benzoic acid propyl ester Formula: C50H62O8 MolecularWeight: 791.02248

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=C(C=C(C=C1C)CC(C2=CC(=C(C(=C2)C)C(=O)OCCC)C)(C3=CC(=C(C(=C3)C)C(=O)OCCC)C)C4=CC(=C(C(=C4)C)C(=O)OCCC)C)C

Isomeric SMILES

CCCOC(=O)C1=C(C=C(C=C1C)CC(C2=CC(=C(C(=C2)C)C(=O)OCCC)C)(C3=CC(=C(C(=C3)C)C(=O)OCCC)C)C4=CC(=C(C(=C4)C)C(=O)OCCC)C)C

InChI

InChI=1S/C50H62O8/c1-13-17-55-46(51)42-30(5)21-38(22-31(42)6)29-50(39-23-32(7)43(33(8)24-39)47(52)56-18-14-2,40-25-34(9)44(35(10)26-40)48(53)57-19-15-3)41-27-36(11)45(37(12)28-41)49(54)58-20-16-4/h21-28H,13-20,29H2,1-12H3