ethyl 3-nitro-5-[(2-phenylpyrimidin-5-yl)carbamoyl]benzoate

Systemtic Name: ethyl 3-nitro-5-[(2-phenylpyrimidin-5-yl)carbamoyl]benzoate Openeye Name: ethyl 3-nitro-5-[(2-phenylpyrimidin-5-yl)carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[(2-phenyl-5-pyrimidinyl)amino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[(2-phenylpyrimidin-5-yl)carbamoyl]benzoate Traditional Name: 3-nitro-5-[(2-phenylpyrimidin-5-yl)carbamoyl]benzoic acid ethyl ester Formula: C20H16N4O5 MolecularWeight: 392.36484

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CN=C(N=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CN=C(N=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H16N4O5/c1-2-29-20(26)15-8-14(9-17(10-15)24(27)28)19(25)23-16-11-21-18(22-12-16)13-6-4-3-5-7-13/h3-12H,2H2,1H3,(H,23,25)