tert-butyl (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxyphenyl]carbonylamino]-3-methyl-pentanoate

Systemtic Name: tert-butyl (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxyphenyl]carbonylamino]-3-methyl-pentanoate Openeye Name: tert-butyl (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]amino]-3-methyl-pentanoate CAS Name: (2S)-2-[[[2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]phenyl]-oxomethyl]amino]-3-methylpentanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]amino]-3-methylpentanoate Traditional Name: (2S)-2-[[2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoyl]amino]-3-methyl-valeric acid tert-butyl ester Formula: C23H31N3O6 MolecularWeight: 445.50874

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC(C)(C)C)NC(=O)C1=CC=CC=C1OC2=NC(=CC(=N2)OC)OC

Isomeric SMILES

CCC(C)[C@@H](C(=O)OC(C)(C)C)NC(=O)C1=CC=CC=C1OC2=NC(=CC(=N2)OC)OC

InChI

InChI=1S/C23H31N3O6/c1-8-14(2)19(21(28)32-23(3,4)5)26-20(27)15-11-9-10-12-16(15)31-22-24-17(29-6)13-18(25-22)30-7/h9-14,19H,8H2,1-7H3,(H,26,27)/t14?,19-/m0/s1