4-[5-(4-phenylbutoxy)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(4-phenylbutoxy)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(4-phenylbutoxy)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-(4-phenylbutoxy)-1H-pyrimidin-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(4-phenylbutoxy)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-(4-phenylbutoxy)-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C20H20N2O2 MolecularWeight: 320.385

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCOC2=CNC(=C3C=CC(=O)C=C3)N=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCCOC2=CNC(=C3C=CC(=O)C=C3)N=C2

InChI

InChI=1S/C20H20N2O2/c23-18-11-9-17(10-12-18)20-21-14-19(15-22-20)24-13-5-4-8-16-6-2-1-3-7-16/h1-3,6-7,9-12,14-15,21H,4-5,8,13H2