(4E)-4-(6-chloranyl-2-phenyl-1H-pyrimidin-4-ylidene)-3-oxidanyl-cyclohexa-2,5-dien-1-one

Systemtic Name: (4E)-4-(6-chloranyl-2-phenyl-1H-pyrimidin-4-ylidene)-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-(6-chloro-2-phenyl-1H-pyrimidin-4-ylidene)-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-(6-chloro-2-phenyl-1H-pyrimidin-4-ylidene)-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-(6-chloro-2-phenyl-1H-pyrimidin-4-ylidene)-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-(6-chloro-2-phenyl-1H-pyrimidin-4-ylidene)-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C16H11ClN2O2 MolecularWeight: 298.72374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=C3C=CC(=O)C=C3O)C=C(N2)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=N/C(=C/3\C=CC(=O)C=C3O)/C=C(N2)Cl

InChI

InChI=1S/C16H11ClN2O2/c17-15-9-13(12-7-6-11(20)8-14(12)21)18-16(19-15)10-4-2-1-3-5-10/h1-9,21H,(H,18,19)/b13-12+