2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]methoxy]-1,3-benzothiazole-7-carboxylic acid

Systemtic Name: 2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]methoxy]-1,3-benzothiazole-7-carboxylic acid Openeye Name: 2-[(4-tert-butoxycarbonylpiperazin-1-yl)methoxy]-1,3-benzothiazole-7-carboxylic acid CAS Name: 2-[[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]methoxy]-1,3-benzothiazole-7-carboxylic acid IUPAC Name: 2-[[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]methoxy]-1,3-benzothiazole-7-carboxylic acid Traditional Name: 2-[(4-tert-butoxycarbonylpiperazino)methoxy]-1,3-benzothiazole-7-carboxylic acid Formula: C18H23N3O5S MolecularWeight: 393.45732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)COC2=NC3=CC=CC(=C3S2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)COC2=NC3=CC=CC(=C3S2)C(=O)O

InChI

InChI=1S/C18H23N3O5S/c1-18(2,3)26-17(24)21-9-7-20(8-10-21)11-25-16-19-13-6-4-5-12(15(22)23)14(13)27-16/h4-6H,7-11H2,1-3H3,(H,22,23)