3-[4-(2-chloroethyloxy)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: 3-[4-(2-chloroethyloxy)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: 2-(tert-butoxycarbonylamino)-3-[4-(2-chloroethoxy)phenyl]propanoate CAS Name: 3-[4-(2-chloroethoxy)phenyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoate IUPAC Name: 3-[4-(2-chloroethoxy)phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-[4-(2-chloroethoxy)phenyl]propionate Formula: C16H21ClNO5- MolecularWeight: 342.79464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCCCl)C(=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CC=C(C=C1)OCCCl)C(=O)[O-]

InChI

InChI=1S/C16H22ClNO5/c1-16(2,3)23-15(21)18-13(14(19)20)10-11-4-6-12(7-5-11)22-9-8-17/h4-7,13H,8-10H2,1-3H3,(H,18,21)(H,19,20)/p-1