dimethyl 2-(2,6-diphenylpyrimidin-4-yl)propanedioate

Systemtic Name: dimethyl 2-(2,6-diphenylpyrimidin-4-yl)propanedioate Openeye Name: dimethyl 2-(2,6-diphenylpyrimidin-4-yl)propanedioate CAS Name: 2-(2,6-diphenyl-4-pyrimidinyl)propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-(2,6-diphenylpyrimidin-4-yl)propanedioate Traditional Name: 2-(2,6-diphenylpyrimidin-4-yl)malonic acid dimethyl ester Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=NC(=NC(=C1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C(C1=NC(=NC(=C1)C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C21H18N2O4/c1-26-20(24)18(21(25)27-2)17-13-16(14-9-5-3-6-10-14)22-19(23-17)15-11-7-4-8-12-15/h3-13,18H,1-2H3