[2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] (2R)-2-benzamido-3-methyl-butanoate

Systemtic Name: [2-(2,4-dimethoxyphenyl)-2-oxidanylidene-ethyl] (2R)-2-benzamido-3-methyl-butanoate Openeye Name: [2-(2,4-dimethoxyphenyl)-2-oxo-ethyl] (2R)-2-benzamido-3-methyl-butanoate CAS Name: (2R)-2-benzamido-3-methylbutanoic acid [2-(2,4-dimethoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethoxyphenyl)-2-oxoethyl] (2R)-2-benzamido-3-methylbutanoate Traditional Name: (2R)-2-benzamido-3-methyl-butyric acid [2-(2,4-dimethoxyphenyl)-2-keto-ethyl] ester Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO6/c1-14(2)20(23-21(25)15-8-6-5-7-9-15)22(26)29-13-18(24)17-11-10-16(27-3)12-19(17)28-4/h5-12,14,20H,13H2,1-4H3,(H,23,25)/t20-/m1/s1