methyl 3-[2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: methyl 3-[2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-(2,2-dimethyl-1-oxopropyl)imino-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-(2-pivaloylimino-1,3-benzothiazol-3-yl)propionic acid methyl ester Formula: C16H20N2O3S MolecularWeight: 320.4066

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N=C1N(C2=CC=CC=C2S1)CCC(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)N=C1N(C2=CC=CC=C2S1)CCC(=O)OC

InChI

InChI=1S/C16H20N2O3S/c1-16(2,3)14(20)17-15-18(10-9-13(19)21-4)11-7-5-6-8-12(11)22-15/h5-8H,9-10H2,1-4H3