3-[4-aminocarbonyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]propanoic acid

Systemtic Name: 3-[4-aminocarbonyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]propanoic acid Openeye Name: 3-[3-[2-(tert-butoxycarbonylamino)phenyl]-4-carbamoyl-phenyl]propanoic acid CAS Name: 3-[4-carbamoyl-3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]phenyl]phenyl]propanoic acid IUPAC Name: 3-[4-carbamoyl-3-[2-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]propanoic acid Traditional Name: 3-[3-[2-(tert-butoxycarbonylamino)phenyl]-4-carbamoyl-phenyl]propionic acid Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC=C1C2=C(C=CC(=C2)CCC(=O)O)C(=O)N

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC=C1C2=C(C=CC(=C2)CCC(=O)O)C(=O)N

InChI

InChI=1S/C21H24N2O5/c1-21(2,3)28-20(27)23-17-7-5-4-6-14(17)16-12-13(9-11-18(24)25)8-10-15(16)19(22)26/h4-8,10,12H,9,11H2,1-3H3,(H2,22,26)(H,23,27)(H,24,25)