tert-butyl N-[(4S,5S)-2,2-dimethyl-4-(2-phenylethynyl)-1,3-dioxan-5-yl]carbamate

Systemtic Name: tert-butyl N-[(4S,5S)-2,2-dimethyl-4-(2-phenylethynyl)-1,3-dioxan-5-yl]carbamate Openeye Name: tert-butyl N-[(4S,5S)-2,2-dimethyl-4-(2-phenylethynyl)-1,3-dioxan-5-yl]carbamate CAS Name: N-[(4S,5S)-2,2-dimethyl-4-(2-phenylethynyl)-1,3-dioxan-5-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(4S,5S)-2,2-dimethyl-4-(2-phenylethynyl)-1,3-dioxan-5-yl]carbamate Traditional Name: N-[(4S,5S)-2,2-dimethyl-4-(2-phenylethynyl)-1,3-dioxan-5-yl]carbamic acid tert-butyl ester Formula: C19H25NO4 MolecularWeight: 331.4061

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(O1)C#CC2=CC=CC=C2)NC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(OC[C@@H]([C@@H](O1)C#CC2=CC=CC=C2)NC(=O)OC(C)(C)C)C

InChI

InChI=1S/C19H25NO4/c1-18(2,3)24-17(21)20-15-13-22-19(4,5)23-16(15)12-11-14-9-7-6-8-10-14/h6-10,15-16H,13H2,1-5H3,(H,20,21)/t15-,16-/m0/s1