(2,6-ditert-butyl-4-methyl-phenyl) 2,2-dimethyl-3-(phenylmethoxymethyl)cyclopropane-1-carboxylate

Systemtic Name: (2,6-ditert-butyl-4-methyl-phenyl) 2,2-dimethyl-3-(phenylmethoxymethyl)cyclopropane-1-carboxylate Openeye Name: (2,6-ditert-butyl-4-methyl-phenyl) 3-(benzyloxymethyl)-2,2-dimethyl-cyclopropanecarboxylate CAS Name: 2,2-dimethyl-3-(phenylmethoxymethyl)-1-cyclopropanecarboxylic acid (2,6-ditert-butyl-4-methylphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-methylphenyl) 2,2-dimethyl-3-(phenylmethoxymethyl)cyclopropane-1-carboxylate Traditional Name: 3-(benzoxymethyl)-2,2-dimethyl-cyclopropanecarboxylic acid (2,6-ditert-butyl-4-methyl-phenyl) ester Formula: C29H40O3 MolecularWeight: 436.6261

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)C2C(C2(C)C)COCC3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)C2C(C2(C)C)COCC3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C29H40O3/c1-19-15-21(27(2,3)4)25(22(16-19)28(5,6)7)32-26(30)24-23(29(24,8)9)18-31-17-20-13-11-10-12-14-20/h10-16,23-24H,17-18H2,1-9H3