3-[[3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylcarbamoylamino]phenyl]carbonylamino]propanoic acid

Systemtic Name: 3-[[3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylcarbamoylamino]phenyl]carbonylamino]propanoic acid Openeye Name: 3-[[3-[3-(tert-butoxycarbonylamino)propylcarbamoylamino]benzoyl]amino]propanoic acid CAS Name: 3-[[[3-[[[3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propylamino]-oxomethyl]amino]phenyl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[3-[3-[(2-methylpropan-2-yl)oxycarbonylamino]propylcarbamoylamino]benzoyl]amino]propanoic acid Traditional Name: 3-[[3-[3-(tert-butoxycarbonylamino)propylcarbamoylamino]benzoyl]amino]propionic acid Formula: C19H28N4O6 MolecularWeight: 408.44882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCNC(=O)NC1=CC=CC(=C1)C(=O)NCCC(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCCCNC(=O)NC1=CC=CC(=C1)C(=O)NCCC(=O)O

InChI

InChI=1S/C19H28N4O6/c1-19(2,3)29-18(28)22-10-5-9-21-17(27)23-14-7-4-6-13(12-14)16(26)20-11-8-15(24)25/h4,6-7,12H,5,8-11H2,1-3H3,(H,20,26)(H,22,28)(H,24,25)(H2,21,23,27)