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

Systemtic Name: (4E)-4-(2-azanyl-5-phenyl-1H-pyrimidin-6-ylidene)-3-oxidanyl-cyclohexa-2,5-dien-1-one Openeye Name: (4E)-4-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-hydroxy-cyclohexa-2,5-dien-1-one CAS Name: (4E)-4-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-hydroxy-1-cyclohexa-2,5-dienone IUPAC Name: (4E)-4-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-hydroxycyclohexa-2,5-dien-1-one Traditional Name: (4E)-4-(2-amino-5-phenyl-1H-pyrimidin-6-ylidene)-3-hydroxy-cyclohexa-2,5-dien-1-one Formula: C16H13N3O2 MolecularWeight: 279.29332

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CN=C(NC2=C3C=CC(=O)C=C3O)N

Isomeric SMILES

C1=CC=C(C=C1)C\2=CN=C(N/C2=C/3\C=CC(=O)C=C3O)N

InChI

InChI=1S/C16H13N3O2/c17-16-18-9-13(10-4-2-1-3-5-10)15(19-16)12-7-6-11(20)8-14(12)21/h1-9,21H,(H3,17,18,19)/b15-12+