tert-butyl N-methylcarbamate; 3-ethoxycarbonyl-5-[(2-methylpropan-2-yl)oxy]-5-oxidanylidene-2-(3-phenethylphenyl)pentanoate

Systemtic Name: tert-butyl N-methylcarbamate; 3-ethoxycarbonyl-5-[(2-methylpropan-2-yl)oxy]-5-oxidanylidene-2-(3-phenethylphenyl)pentanoate Openeye Name: 5-tert-butoxy-3-ethoxycarbonyl-5-oxo-2-(3-phenethylphenyl)pentanoate; tert-butyl N-methylcarbamate CAS Name: 3-ethoxycarbonyl-5-[(2-methylpropan-2-yl)oxy]-5-oxo-2-(3-phenethylphenyl)pentanoate; N-methylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-methylcarbamate; 3-ethoxycarbonyl-5-[(2-methylpropan-2-yl)oxy]-5-oxo-2-(3-phenethylphenyl)pentanoate Traditional Name: 5-tert-butoxy-3-carbethoxy-5-keto-2-(3-phenethylphenyl)valerate; N-methylcarbamic acid tert-butyl ester Formula: C32H44NO8- MolecularWeight: 570.69366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)OC(C)(C)C)C(C1=CC=CC(=C1)CCC2=CC=CC=C2)C(=O)[O-].CC(C)(C)OC(=O)NC

Isomeric SMILES

CCOC(=O)C(CC(=O)OC(C)(C)C)C(C1=CC=CC(=C1)CCC2=CC=CC=C2)C(=O)[O-].CC(C)(C)OC(=O)NC

InChI

InChI=1S/C26H32O6.C6H13NO2/c1-5-31-25(30)21(17-22(27)32-26(2,3)4)23(24(28)29)20-13-9-12-19(16-20)15-14-18-10-7-6-8-11-18;1-6(2,3)9-5(8)7-4/h6-13,16,21,23H,5,14-15,17H2,1-4H3,(H,28,29);1-4H3,(H,7,8)/p-1