2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(3-phenylmethoxy-1,2-thiazol-5-yl)propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(3-phenylmethoxy-1,2-thiazol-5-yl)propanoic acid Openeye Name: 2-(3-benzyloxyisothiazol-5-yl)-2-(tert-butoxycarbonylamino)propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(3-phenylmethoxy-5-isothiazolyl)propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(3-phenylmethoxy-1,2-thiazol-5-yl)propanoic acid Traditional Name: 2-(3-benzoxyisothiazol-5-yl)-2-(tert-butoxycarbonylamino)propionic acid Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C)(C1=CC(=NS1)OCC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(C)(C1=CC(=NS1)OCC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C18H22N2O5S/c1-17(2,3)25-16(23)19-18(4,15(21)22)13-10-14(20-26-13)24-11-12-8-6-5-7-9-12/h5-10H,11H2,1-4H3,(H,19,23)(H,21,22)