(6E)-6-[4-(4-bromanylphenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[4-(4-bromanylphenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[4-(4-bromophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[4-(4-bromophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxy-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[4-(4-bromophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-methoxycyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[4-(4-bromophenoxy)-5-methyl-3-pyrazolin-3-ylidene]-3-methoxy-cyclohexa-2,4-dien-1-one Formula: C17H15BrN2O3 MolecularWeight: 375.2166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC(=CC2=O)OC)NN1)OC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(/C(=C\2/C=CC(=CC2=O)OC)/NN1)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H15BrN2O3/c1-10-17(23-12-5-3-11(18)4-6-12)16(20-19-10)14-8-7-13(22-2)9-15(14)21/h3-9,19-20H,1-2H3/b16-14+