2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-pyridin-2-yl-1,3-benzoxazol-5-yl)propanoic acid

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-pyridin-2-yl-1,3-benzoxazol-5-yl)propanoic acid Openeye Name: 2-(tert-butoxycarbonylamino)-3-[2-(2-pyridyl)-1,3-benzoxazol-5-yl]propanoic acid CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-[2-(2-pyridinyl)-1,3-benzoxazol-5-yl]propanoic acid IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(2-pyridin-2-yl-1,3-benzoxazol-5-yl)propanoic acid Traditional Name: 2-(tert-butoxycarbonylamino)-3-[2-(2-pyridyl)-1,3-benzoxazol-5-yl]propionic acid Formula: C20H21N3O5 MolecularWeight: 383.39784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC2=C(C=C1)OC(=N2)C3=CC=CC=N3)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC2=C(C=C1)OC(=N2)C3=CC=CC=N3)C(=O)O

InChI

InChI=1S/C20H21N3O5/c1-20(2,3)28-19(26)23-15(18(24)25)11-12-7-8-16-14(10-12)22-17(27-16)13-6-4-5-9-21-13/h4-10,15H,11H2,1-3H3,(H,23,26)(H,24,25)