(6E)-3-butoxy-6-[5-(4-pentoxyphenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-3-butoxy-6-[5-(4-pentoxyphenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-3-butoxy-6-[5-(4-pentoxyphenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-3-butoxy-6-[5-(4-pentoxyphenyl)-1H-pyrimidin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-3-butoxy-6-[5-(4-pentoxyphenyl)-1H-pyrimidin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[5-(4-amoxyphenyl)-1H-pyrimidin-2-ylidene]-3-butoxy-cyclohexa-2,4-dien-1-one Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=CNC(=C3C=CC(=CC3=O)OCCCC)N=C2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=CN/C(=C\3/C=CC(=CC3=O)OCCCC)/N=C2

InChI

InChI=1S/C25H30N2O3/c1-3-5-7-15-29-21-10-8-19(9-11-21)20-17-26-25(27-18-20)23-13-12-22(16-24(23)28)30-14-6-4-2/h8-13,16-18,26H,3-7,14-15H2,1-2H3/b25-23+