3-[6-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]dibenzofuran-4-yl]propanoic acid; sodium

Systemtic Name: 3-[6-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]dibenzofuran-4-yl]propanoic acid; sodium Openeye Name: 3-[6-[2-(tert-butoxycarbonylamino)ethyl]dibenzofuran-4-yl]propanoic acid; sodium CAS Name: 3-[6-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]ethyl]-4-dibenzofuranyl]propanoic acid; sodium IUPAC Name: 3-[6-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]dibenzofuran-4-yl]propanoic acid; sodium Traditional Name: 3-[6-[2-(tert-butoxycarbonylamino)ethyl]dibenzofuran-4-yl]propionic acid; sodium Formula: C22H25NNaO5 MolecularWeight: 406.42737

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC1=CC=CC2=C1OC3=C2C=CC=C3CCC(=O)O.[Na]

Isomeric SMILES

CC(C)(C)OC(=O)NCCC1=CC=CC2=C1OC3=C2C=CC=C3CCC(=O)O.[Na]

InChI

InChI=1S/C22H25NO5.Na/c1-22(2,3)28-21(26)23-13-12-15-7-5-9-17-16-8-4-6-14(10-11-18(24)25)19(16)27-20(15)17;/h4-9H,10-13H2,1-3H3,(H,23,26)(H,24,25);