N-[[4-(5-chloranylpyrimidin-2-yl)oxy-3-methyl-phenyl]-propanoyl-carbamoyl]-2-nitro-benzamide

Systemtic Name: N-[[4-(5-chloranylpyrimidin-2-yl)oxy-3-methyl-phenyl]-propanoyl-carbamoyl]-2-nitro-benzamide Openeye Name: N-[[4-(5-chloropyrimidin-2-yl)oxy-3-methyl-phenyl]-propanoyl-carbamoyl]-2-nitro-benzamide CAS Name: N-[[4-[(5-chloro-2-pyrimidinyl)oxy]-3-methyl-N-(1-oxopropyl)anilino]-oxomethyl]-2-nitrobenzamide IUPAC Name: N-[[4-(5-chloropyrimidin-2-yl)oxy-3-methylphenyl]-propanoylcarbamoyl]-2-nitrobenzamide Traditional Name: N-[[4-(5-chloropyrimidin-2-yl)oxy-3-methyl-phenyl]-propionyl-carbamoyl]-2-nitro-benzamide Formula: C22H18ClN5O6 MolecularWeight: 483.86122

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1=CC(=C(C=C1)OC2=NC=C(C=N2)Cl)C)C(=O)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N(C1=CC(=C(C=C1)OC2=NC=C(C=N2)Cl)C)C(=O)NC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C22H18ClN5O6/c1-3-19(29)27(22(31)26-20(30)16-6-4-5-7-17(16)28(32)33)15-8-9-18(13(2)10-15)34-21-24-11-14(23)12-25-21/h4-12H,3H2,1-2H3,(H,26,30,31)