(2,6-ditert-butyl-4-methyl-phenyl) (4R,5S)-5-methoxy-4-(4-methoxyphenyl)cyclopentene-1-carboxylate

Systemtic Name: (2,6-ditert-butyl-4-methyl-phenyl) (4R,5S)-5-methoxy-4-(4-methoxyphenyl)cyclopentene-1-carboxylate Openeye Name: (2,6-ditert-butyl-4-methyl-phenyl) (4R,5S)-5-methoxy-4-(4-methoxyphenyl)cyclopentene-1-carboxylate CAS Name: (4R,5S)-5-methoxy-4-(4-methoxyphenyl)-1-cyclopentenecarboxylic acid (2,6-ditert-butyl-4-methylphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-methylphenyl) (4R,5S)-5-methoxy-4-(4-methoxyphenyl)cyclopentene-1-carboxylate Traditional Name: (4R,5S)-5-methoxy-4-(4-methoxyphenyl)cyclopentene-1-carboxylic acid (2,6-ditert-butyl-4-methyl-phenyl) ester Formula: C29H38O4 MolecularWeight: 450.60962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)C2=CCC(C2OC)C3=CC=C(C=C3)OC)C(C)(C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C(C)(C)C)OC(=O)C2=CC[C@@H]([C@@H]2OC)C3=CC=C(C=C3)OC)C(C)(C)C

InChI

InChI=1S/C29H38O4/c1-18-16-23(28(2,3)4)26(24(17-18)29(5,6)7)33-27(30)22-15-14-21(25(22)32-9)19-10-12-20(31-8)13-11-19/h10-13,15-17,21,25H,14H2,1-9H3/t21-,25+/m1/s1