ethyl 2-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]ethanoate

Systemtic Name: ethyl 2-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]ethanoate Openeye Name: ethyl 2-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]acetate CAS Name: 2-[4-methyl-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidin-5-yl]acetate Traditional Name: 2-[4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidin-5-yl]acetic acid ethyl ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=C(N=C(N=C1C)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CC1=C(N=C(N=C1C)C2=CC=CC=C2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O4/c1-3-28-19(25)13-18-14(2)22-21(15-8-5-4-6-9-15)23-20(18)16-10-7-11-17(12-16)24(26)27/h4-12H,3,13H2,1-2H3