2-(4-tert-butylphenyl)-3-(4,6-dimethylpyrimidin-2-yl)oxy-6-ethyl-chromen-4-one

Systemtic Name: 2-(4-tert-butylphenyl)-3-(4,6-dimethylpyrimidin-2-yl)oxy-6-ethyl-chromen-4-one Openeye Name: 2-(4-tert-butylphenyl)-3-(4,6-dimethylpyrimidin-2-yl)oxy-6-ethyl-chromen-4-one CAS Name: 2-(4-tert-butylphenyl)-3-[(4,6-dimethyl-2-pyrimidinyl)oxy]-6-ethyl-1-benzopyran-4-one IUPAC Name: 2-(4-tert-butylphenyl)-3-(4,6-dimethylpyrimidin-2-yl)oxy-6-ethylchromen-4-one Traditional Name: 2-(4-tert-butylphenyl)-3-(4,6-dimethylpyrimidin-2-yl)oxy-6-ethyl-chromone Formula: C27H28N2O3 MolecularWeight: 428.52282

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC3=NC(=CC(=N3)C)C)C4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)OC(=C(C2=O)OC3=NC(=CC(=N3)C)C)C4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H28N2O3/c1-7-18-8-13-22-21(15-18)23(30)25(32-26-28-16(2)14-17(3)29-26)24(31-22)19-9-11-20(12-10-19)27(4,5)6/h8-15H,7H2,1-6H3