methyl 3-(3,5-dimethyl-4-oxidanyl-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl 3-(3,5-dimethyl-4-oxidanyl-phenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl 2-(tert-butoxycarbonylamino)-3-(4-hydroxy-3,5-dimethyl-phenyl)propanoate CAS Name: 3-(4-hydroxy-3,5-dimethylphenyl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-hydroxy-3,5-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-(4-hydroxy-3,5-dimethyl-phenyl)propionic acid methyl ester Formula: C17H25NO5 MolecularWeight: 323.3841

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1O)C)CC(C(=O)OC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1O)C)CC(C(=O)OC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H25NO5/c1-10-7-12(8-11(2)14(10)19)9-13(15(20)22-6)18-16(21)23-17(3,4)5/h7-8,13,19H,9H2,1-6H3,(H,18,21)