tert-butyl 3-(2-azanyl-1,3-thiazol-4-yl)-2-[(E)-2-oxidanylideneethylideneamino]oxy-propanoate

Systemtic Name: tert-butyl 3-(2-azanyl-1,3-thiazol-4-yl)-2-[(E)-2-oxidanylideneethylideneamino]oxy-propanoate Openeye Name: tert-butyl 3-(2-aminothiazol-4-yl)-2-[(E)-2-oxoethylideneamino]oxy-propanoate CAS Name: 3-(2-amino-4-thiazolyl)-2-[(E)-2-oxoethylideneamino]oxypropanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-(2-amino-1,3-thiazol-4-yl)-2-[(E)-2-oxoethylideneamino]oxypropanoate Traditional Name: 3-(2-aminothiazol-4-yl)-2-[(E)-2-ketoethylideneamino]oxy-propionic acid tert-butyl ester Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CC1=CSC(=N1)N)ON=CC=O

Isomeric SMILES

CC(C)(C)OC(=O)C(CC1=CSC(=N1)N)O/N=C/C=O

InChI

InChI=1S/C12H17N3O4S/c1-12(2,3)18-10(17)9(19-14-4-5-16)6-8-7-20-11(13)15-8/h4-5,7,9H,6H2,1-3H3,(H2,13,15)/b14-4+