tert-butyl (3S)-1,1-bis(oxidanylidene)-3-(phenylmethoxymethyl)-3H-1,2-thiazole-2-carboxylate

Systemtic Name: tert-butyl (3S)-1,1-bis(oxidanylidene)-3-(phenylmethoxymethyl)-3H-1,2-thiazole-2-carboxylate Openeye Name: tert-butyl (3S)-3-(benzyloxymethyl)-1,1-dioxo-3H-isothiazole-2-carboxylate CAS Name: (3S)-1,1-dioxo-3-(phenylmethoxymethyl)-3H-isothiazole-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-1,1-dioxo-3-(phenylmethoxymethyl)-3H-1,2-thiazole-2-carboxylate Traditional Name: (3S)-3-(benzoxymethyl)-1,1-diketo-3H-isothiazole-2-carboxylic acid tert-butyl ester Formula: C16H21NO5S MolecularWeight: 339.40664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C(C=CS1(=O)=O)COCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1[C@@H](C=CS1(=O)=O)COCC2=CC=CC=C2

InChI

InChI=1S/C16H21NO5S/c1-16(2,3)22-15(18)17-14(9-10-23(17,19)20)12-21-11-13-7-5-4-6-8-13/h4-10,14H,11-12H2,1-3H3/t14-/m0/s1