2-(1,3-dihydro-2-benzothiophen-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoic acid

Systemtic Name: 2-(1,3-dihydro-2-benzothiophen-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]ethanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-2-(1,3-dihydro-2-benzothiophen-4-yl)acetic acid CAS Name: 2-(1,3-dihydro-2-benzothiophen-4-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]acetic acid IUPAC Name: 2-(1,3-dihydro-2-benzothiophen-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid Traditional Name: 2-(tert-butoxycarbonylamino)-2-(1,3-dihydroisobenzothiophen-4-yl)acetic acid Formula: C15H19NO4S MolecularWeight: 309.38066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(C1=CC=CC2=C1CSC2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(C1=CC=CC2=C1CSC2)C(=O)O

InChI

InChI=1S/C15H19NO4S/c1-15(2,3)20-14(19)16-12(13(17)18)10-6-4-5-9-7-21-8-11(9)10/h4-6,12H,7-8H2,1-3H3,(H,16,19)(H,17,18)