3-(4-chloranyl-3-nitro-phenyl)-N-(4,6-dimethylpyrimidin-2-yl)prop-2-enamide

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-N-(4,6-dimethylpyrimidin-2-yl)prop-2-enamide Openeye Name: 3-(4-chloro-3-nitro-phenyl)-N-(4,6-dimethylpyrimidin-2-yl)prop-2-enamide CAS Name: 3-(4-chloro-3-nitrophenyl)-N-(4,6-dimethyl-2-pyrimidinyl)-2-propenamide IUPAC Name: 3-(4-chloro-3-nitrophenyl)-N-(4,6-dimethylpyrimidin-2-yl)prop-2-enamide Traditional Name: 3-(4-chloro-3-nitro-phenyl)-N-(4,6-dimethylpyrimidin-2-yl)acrylamide Formula: C15H13ClN4O3 MolecularWeight: 332.74172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C15H13ClN4O3/c1-9-7-10(2)18-15(17-9)19-14(21)6-4-11-3-5-12(16)13(8-11)20(22)23/h3-8H,1-2H3,(H,17,18,19,21)