6-methyl-2-[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-2-[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenyl-phenyl]-4-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 2-(3-tert-butoxycarbonyl-4-phenyl-phenyl)-6-methyl-4-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-2-[3-[(2-methylpropan-2-yl)oxy-oxomethyl]-4-phenylphenyl]-4-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-2-[3-[(2-methylpropan-2-yl)oxycarbonyl]-4-phenylphenyl]-4-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-(3-tert-butoxycarbonyl-4-phenyl-phenyl)-4-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C23H22N2O5 MolecularWeight: 406.43118

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)C2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C)C(=O)O

Isomeric SMILES

CC1=C(C(=O)N=C(N1)C2=CC(=C(C=C2)C3=CC=CC=C3)C(=O)OC(C)(C)C)C(=O)O

InChI

InChI=1S/C23H22N2O5/c1-13-18(21(27)28)20(26)25-19(24-13)15-10-11-16(14-8-6-5-7-9-14)17(12-15)22(29)30-23(2,3)4/h5-12H,1-4H3,(H,27,28)(H,24,25,26)