4-[5-[2-(2H-pyran-6-yloxy)heptoxy]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-[2-(2H-pyran-6-yloxy)heptoxy]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-[2-(2H-pyran-6-yloxy)heptoxy]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-[2-(2H-pyran-6-yloxy)heptoxy]-1H-pyrimidin-2-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-[2-(2H-pyran-6-yloxy)heptoxy]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-[2-(2H-pyran-6-yloxy)heptoxy]-1H-pyrimidin-2-ylidene]cyclohexa-2,5-dien-1-one Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(COC1=CNC(=C2C=CC(=O)C=C2)N=C1)OC3=CC=CCO3

Isomeric SMILES

CCCCCC(COC1=CNC(=C2C=CC(=O)C=C2)N=C1)OC3=CC=CCO3

InChI

InChI=1S/C22H26N2O4/c1-2-3-4-7-19(28-21-8-5-6-13-26-21)16-27-20-14-23-22(24-15-20)17-9-11-18(25)12-10-17/h5-6,8-12,14-15,19,23H,2-4,7,13,16H2,1H3