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

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(3-phenylmethoxy-1,2-thiazol-5-yl)ethanoic acid Openeye Name: 2-(3-benzyloxyisothiazol-5-yl)-2-(tert-butoxycarbonylamino)acetic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-2-(3-phenylmethoxy-5-isothiazolyl)acetic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-(3-phenylmethoxy-1,2-thiazol-5-yl)acetic acid Traditional Name: 2-(3-benzoxyisothiazol-5-yl)-2-(tert-butoxycarbonylamino)acetic acid Formula: C17H20N2O5S MolecularWeight: 364.4161

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H20N2O5S/c1-17(2,3)24-16(22)18-14(15(20)21)12-9-13(19-25-12)23-10-11-7-5-4-6-8-11/h4-9,14H,10H2,1-3H3,(H,18,22)(H,20,21)