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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CCC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC=C1NC(=O)C2=CC=C(C=C2)CCC(=O)O

InChI

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