6-[5-(2-bromanylphenoxy)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[5-(2-bromanylphenoxy)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[5-(2-bromophenoxy)-1H-pyrimidin-6-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Formula: C17H13BrN2O3 MolecularWeight: 373.20072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=C2C(=CN=CN2)OC3=CC=CC=C3Br)C=C1

Isomeric SMILES

COC1=CC(=O)C(=C2C(=CN=CN2)OC3=CC=CC=C3Br)C=C1

InChI

InChI=1S/C17H13BrN2O3/c1-22-11-6-7-12(14(21)8-11)17-16(9-19-10-20-17)23-15-5-3-2-4-13(15)18/h2-10H,1H3,(H,19,20)