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

Systemtic Name: 6-[4-(2-bromanylphenoxy)-1,2-dihydropyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(2-bromophenoxy)-1,2-dihydropyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(2-bromophenoxy)-1,2-dihydropyrazol-3-ylidene]-3-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(2-bromophenoxy)-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(2-bromophenoxy)-3-pyrazolin-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Formula: C16H13BrN2O3 MolecularWeight: 361.19002

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=O)C(=C2C(=CNN2)OC3=CC=CC=C3Br)C=C1

Isomeric SMILES

COC1=CC(=O)C(=C2C(=CNN2)OC3=CC=CC=C3Br)C=C1

InChI

InChI=1S/C16H13BrN2O3/c1-21-10-6-7-11(13(20)8-10)16-15(9-18-19-16)22-14-5-3-2-4-12(14)17/h2-9,18-19H,1H3