[4-[(2S)-2-azanyl-3-methoxy-3-oxidanylidene-propyl]-2-(3,3-dimethylbutanoyloxy)phenyl] 3,3-dimethylbutanoate

Systemtic Name: [4-[(2S)-2-azanyl-3-methoxy-3-oxidanylidene-propyl]-2-(3,3-dimethylbutanoyloxy)phenyl] 3,3-dimethylbutanoate Openeye Name: [4-[(2S)-2-amino-3-methoxy-3-oxo-propyl]-2-(3,3-dimethylbutanoyloxy)phenyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [4-[(2S)-2-amino-3-methoxy-3-oxopropyl]-2-(3,3-dimethyl-1-oxobutoxy)phenyl] ester IUPAC Name: [4-[(2S)-2-amino-3-methoxy-3-oxopropyl]-2-(3,3-dimethylbutanoyloxy)phenyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [4-[(2S)-2-amino-3-keto-3-methoxy-propyl]-2-(3,3-dimethylbutanoyloxy)phenyl] ester Formula: C22H33NO6 MolecularWeight: 407.50052

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=C(C=C(C=C1)CC(C(=O)OC)N)OC(=O)CC(C)(C)C

Isomeric SMILES

CC(C)(C)CC(=O)OC1=C(C=C(C=C1)C[C@@H](C(=O)OC)N)OC(=O)CC(C)(C)C

InChI

InChI=1S/C22H33NO6/c1-21(2,3)12-18(24)28-16-9-8-14(10-15(23)20(26)27-7)11-17(16)29-19(25)13-22(4,5)6/h8-9,11,15H,10,12-13,23H2,1-7H3/t15-/m0/s1