2-butyl-4-methyl-1-[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]-6-oxidanylidene-pyrimidine-5-carboxylic acid

Systemtic Name: 2-butyl-4-methyl-1-[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]-6-oxidanylidene-pyrimidine-5-carboxylic acid Openeye Name: 1-[4-(2-tert-butoxycarbonylphenyl)phenyl]-2-butyl-4-methyl-6-oxo-pyrimidine-5-carboxylic acid CAS Name: 2-butyl-4-methyl-1-[4-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]phenyl]-6-oxo-5-pyrimidinecarboxylic acid IUPAC Name: 2-butyl-4-methyl-1-[4-[2-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]phenyl]-6-oxopyrimidine-5-carboxylic acid Traditional Name: 1-[4-(2-tert-butoxycarbonylphenyl)phenyl]-2-butyl-6-keto-4-methyl-pyrimidine-5-carboxylic acid Formula: C27H30N2O5 MolecularWeight: 462.5375

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(C(=O)N1C2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C(=O)O)C

Isomeric SMILES

CCCCC1=NC(=C(C(=O)N1C2=CC=C(C=C2)C3=CC=CC=C3C(=O)OC(C)(C)C)C(=O)O)C

InChI

InChI=1S/C27H30N2O5/c1-6-7-12-22-28-17(2)23(25(31)32)24(30)29(22)19-15-13-18(14-16-19)20-10-8-9-11-21(20)26(33)34-27(3,4)5/h8-11,13-16H,6-7,12H2,1-5H3,(H,31,32)