(6E)-6-[5-(4-phenylbutyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[5-(4-phenylbutyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[5-(4-phenylbutyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[5-(4-phenylbutyl)-1H-pyrimidin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[5-(4-phenylbutyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[5-(4-phenylbutyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C20H20N2O MolecularWeight: 304.3856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCC2=CNC(=C3C=CC=CC3=O)N=C2

Isomeric SMILES

C1=CC=C(C=C1)CCCCC2=CN/C(=C\3/C=CC=CC3=O)/N=C2

InChI

InChI=1S/C20H20N2O/c23-19-13-7-6-12-18(19)20-21-14-17(15-22-20)11-5-4-10-16-8-2-1-3-9-16/h1-3,6-9,12-15,21H,4-5,10-11H2/b20-18+