[(2S)-1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl] 2,3-dimethoxybenzoate

Systemtic Name: [(2S)-1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl] 2,3-dimethoxybenzoate Openeye Name: [(1S)-2-(4-tert-butylphenyl)-1-methyl-2-oxo-ethyl] 2,3-dimethoxybenzoate CAS Name: 2,3-dimethoxybenzoic acid [(2S)-1-(4-tert-butylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-tert-butylphenyl)-1-oxopropan-2-yl] 2,3-dimethoxybenzoate Traditional Name: 2,3-dimethoxybenzoic acid [(1S)-2-(4-tert-butylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H26O5 MolecularWeight: 370.43884

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)OC(=O)C2=C(C(=CC=C2)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H26O5/c1-14(19(23)15-10-12-16(13-11-15)22(2,3)4)27-21(24)17-8-7-9-18(25-5)20(17)26-6/h7-14H,1-6H3/t14-/m0/s1