butyl (4S,6S)-6-[(2S)-2-benzamido-3-methoxy-3-oxidanylidene-propyl]-2,2-dimethyl-1,3-dioxane-4-carboxylate

Systemtic Name: butyl (4S,6S)-6-[(2S)-2-benzamido-3-methoxy-3-oxidanylidene-propyl]-2,2-dimethyl-1,3-dioxane-4-carboxylate Openeye Name: butyl (4S,6S)-6-[(2S)-2-benzamido-3-methoxy-3-oxo-propyl]-2,2-dimethyl-1,3-dioxane-4-carboxylate CAS Name: (4S,6S)-6-[(2S)-2-benzamido-3-methoxy-3-oxopropyl]-2,2-dimethyl-1,3-dioxane-4-carboxylic acid butyl ester IUPAC Name: butyl (4S,6S)-6-[(2S)-2-benzamido-3-methoxy-3-oxopropyl]-2,2-dimethyl-1,3-dioxane-4-carboxylate Traditional Name: (4S,6S)-6-[(2S)-2-benzamido-3-keto-3-methoxy-propyl]-2,2-dimethyl-1,3-dioxane-4-carboxylic acid butyl ester Formula: C22H31NO7 MolecularWeight: 421.48404

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1CC(OC(O1)(C)C)CC(C(=O)OC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)[C@@H]1C[C@@H](OC(O1)(C)C)C[C@@H](C(=O)OC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H31NO7/c1-5-6-12-28-21(26)18-14-16(29-22(2,3)30-18)13-17(20(25)27-4)23-19(24)15-10-8-7-9-11-15/h7-11,16-18H,5-6,12-14H2,1-4H3,(H,23,24)/t16-,17-,18-/m0/s1