6-[(E)-2-(4-chloranyl-3-nitro-phenyl)ethenyl]-2-propan-2-yl-1H-pyrimidin-4-one

Systemtic Name: 6-[(E)-2-(4-chloranyl-3-nitro-phenyl)ethenyl]-2-propan-2-yl-1H-pyrimidin-4-one Openeye Name: 6-[(E)-2-(4-chloro-3-nitro-phenyl)vinyl]-2-isopropyl-1H-pyrimidin-4-one CAS Name: 6-[(E)-2-(4-chloro-3-nitrophenyl)ethenyl]-2-propan-2-yl-1H-pyrimidin-4-one IUPAC Name: 6-[(E)-2-(4-chloro-3-nitrophenyl)ethenyl]-2-propan-2-yl-1H-pyrimidin-4-one Traditional Name: 6-[(E)-2-(4-chloro-3-nitro-phenyl)vinyl]-2-isopropyl-1H-pyrimidin-4-one Formula: C15H14ClN3O3 MolecularWeight: 319.74296

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC(=O)C=C(N1)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NC(=O)C=C(N1)/C=C/C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C15H14ClN3O3/c1-9(2)15-17-11(8-14(20)18-15)5-3-10-4-6-12(16)13(7-10)19(21)22/h3-9H,1-2H3,(H,17,18,20)/b5-3+