2-hydroxyethyl 4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: 2-hydroxyethyl 4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate Openeye Name: 2-hydroxyethyl 4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-(3-nitrophenyl)-2-phenyl-5-pyrimidinecarboxylic acid 2-hydroxyethyl ester IUPAC Name: 2-hydroxyethyl 4-methyl-6-(3-nitrophenyl)-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-methyl-6-(3-nitrophenyl)-2-phenyl-pyrimidine-5-carboxylic acid 2-hydroxyethyl ester Formula: C20H17N3O5 MolecularWeight: 379.36608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1C(=O)OCCO)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NC(=C1C(=O)OCCO)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H17N3O5/c1-13-17(20(25)28-11-10-24)18(15-8-5-9-16(12-15)23(26)27)22-19(21-13)14-6-3-2-4-7-14/h2-9,12,24H,10-11H2,1H3