(2,6-ditert-butyl-4-methoxy-phenyl) (1S,2S)-2-butyl-1-deuterio-2H-naphthalene-1-carboxylate

Systemtic Name: (2,6-ditert-butyl-4-methoxy-phenyl) (1S,2S)-2-butyl-1-deuterio-2H-naphthalene-1-carboxylate Openeye Name: (2,6-ditert-butyl-4-methoxy-phenyl) (1S,2S)-2-butyl-1-deuterio-2H-naphthalene-1-carboxylate CAS Name: (1S,2S)-2-butyl-1-deuterio-2H-naphthalene-1-carboxylic acid (2,6-ditert-butyl-4-methoxyphenyl) ester IUPAC Name: (2,6-ditert-butyl-4-methoxyphenyl) (1S,2S)-2-butyl-1-deuterio-2H-naphthalene-1-carboxylate Traditional Name: (1S,2S)-2-butyl-1-deuterio-2H-naphthalene-1-carboxylic acid (2,6-ditert-butyl-4-methoxy-phenyl) ester Formula: C30H40O3 MolecularWeight: 449.642962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C=CC2=CC=CC=C2C1C(=O)OC3=C(C=C(C=C3C(C)(C)C)OC)C(C)(C)C

Isomeric SMILES

[2H][C@@]1([C@H](C=CC2=CC=CC=C21)CCCC)C(=O)OC3=C(C=C(C=C3C(C)(C)C)OC)C(C)(C)C

InChI

InChI=1S/C30H40O3/c1-9-10-13-21-17-16-20-14-11-12-15-23(20)26(21)28(31)33-27-24(29(2,3)4)18-22(32-8)19-25(27)30(5,6)7/h11-12,14-19,21,26H,9-10,13H2,1-8H3/t21-,26-/m0/s1/i26D