3-(7-methoxy-1,3-benzodioxol-5-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid

Systemtic Name: 3-(7-methoxy-1,3-benzodioxol-5-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Openeye Name: 3-(tert-butoxycarbonylamino)-3-(7-methoxy-1,3-benzodioxol-5-yl)propanoic acid CAS Name: 3-(7-methoxy-1,3-benzodioxol-5-yl)-3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid IUPAC Name: 3-(7-methoxy-1,3-benzodioxol-5-yl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid Traditional Name: 3-(tert-butoxycarbonylamino)-3-(7-methoxy-1,3-benzodioxol-5-yl)propionic acid Formula: C16H21NO7 MolecularWeight: 339.34044

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC2=C(C(=C1)OC)OCO2

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC2=C(C(=C1)OC)OCO2

InChI

InChI=1S/C16H21NO7/c1-16(2,3)24-15(20)17-10(7-13(18)19)9-5-11(21-4)14-12(6-9)22-8-23-14/h5-6,10H,7-8H2,1-4H3,(H,17,20)(H,18,19)