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

Systemtic Name: 6-[4-(2-bromanylphenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(2-bromophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(2-bromophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(2-bromophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(2-bromophenoxy)-5-methyl-3-pyrazolin-3-ylidene]-3-(4-nitrobenzyl)oxy-cyclohexa-2,4-dien-1-one Formula: C23H18BrN3O5 MolecularWeight: 496.31012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C2C=CC(=CC2=O)OCC3=CC=C(C=C3)[N+](=O)[O-])NN1)OC4=CC=CC=C4Br

Isomeric SMILES

CC1=C(C(=C2C=CC(=CC2=O)OCC3=CC=C(C=C3)[N+](=O)[O-])NN1)OC4=CC=CC=C4Br

InChI

InChI=1S/C23H18BrN3O5/c1-14-23(32-21-5-3-2-4-19(21)24)22(26-25-14)18-11-10-17(12-20(18)28)31-13-15-6-8-16(9-7-15)27(29)30/h2-12,25-26H,13H2,1H3