1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-(6-phenylpyrimidin-4-yl)oxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-(6-phenylpyrimidin-4-yl)oxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-(tert-butoxycarbonylamino)-3,3-dimethyl-butanoyl]-4-(6-phenylpyrimidin-4-yl)oxy-pyrrolidine-2-carboxylic acid CAS Name: 1-[3,3-dimethyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-1-oxobutyl]-4-[(6-phenyl-4-pyrimidinyl)oxy]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[3,3-dimethyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]-4-(6-phenylpyrimidin-4-yl)oxypyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(tert-butoxycarbonylamino)-3,3-dimethyl-butanoyl]-4-(6-phenylpyrimidin-4-yl)oxy-proline Formula: C26H34N4O6 MolecularWeight: 498.57136

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(=O)N1CC(CC1C(=O)O)OC2=NC=NC(=C2)C3=CC=CC=C3)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C(C(=O)N1CC(CC1C(=O)O)OC2=NC=NC(=C2)C3=CC=CC=C3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C26H34N4O6/c1-25(2,3)21(29-24(34)36-26(4,5)6)22(31)30-14-17(12-19(30)23(32)33)35-20-13-18(27-15-28-20)16-10-8-7-9-11-16/h7-11,13,15,17,19,21H,12,14H2,1-6H3,(H,29,34)(H,32,33)