[2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: [2-(3-chloranyl-4-methoxy-phenyl)-2-oxidanylidene-ethyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: [2-(3-chloro-4-methoxy-phenyl)-2-oxo-ethyl] 3-(tert-butoxycarbonylamino)propanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid [2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3-chloro-4-methoxyphenyl)-2-oxoethyl] 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(tert-butoxycarbonylamino)propionic acid [2-(3-chloro-4-methoxy-phenyl)-2-keto-ethyl] ester Formula: C17H22ClNO6 MolecularWeight: 371.81268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)OCC(=O)C1=CC(=C(C=C1)OC)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)OCC(=O)C1=CC(=C(C=C1)OC)Cl

InChI

InChI=1S/C17H22ClNO6/c1-17(2,3)25-16(22)19-8-7-15(21)24-10-13(20)11-5-6-14(23-4)12(18)9-11/h5-6,9H,7-8,10H2,1-4H3,(H,19,22)