4-(3-nitrophenyl)carbonyl-2-phenyl-pyrimidine-5-carboxylic acid

Systemtic Name: 4-(3-nitrophenyl)carbonyl-2-phenyl-pyrimidine-5-carboxylic acid Openeye Name: 4-(3-nitrobenzoyl)-2-phenyl-pyrimidine-5-carboxylic acid CAS Name: 4-[(3-nitrophenyl)-oxomethyl]-2-phenyl-5-pyrimidinecarboxylic acid IUPAC Name: 4-(3-nitrobenzoyl)-2-phenylpyrimidine-5-carboxylic acid Traditional Name: 4-(3-nitrobenzoyl)-2-phenyl-pyrimidine-5-carboxylic acid Formula: C18H11N3O5 MolecularWeight: 349.29704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=C(C(=N2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=C(C(=N2)C(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C18H11N3O5/c22-16(12-7-4-8-13(9-12)21(25)26)15-14(18(23)24)10-19-17(20-15)11-5-2-1-3-6-11/h1-10H,(H,23,24)