6-[[[4-(3-bromophenyl)-5-methyl-2-phenyl-pyrazol-3-yl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[[4-(3-bromophenyl)-5-methyl-2-phenyl-pyrazol-3-yl]amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[[4-(3-bromophenyl)-5-methyl-2-phenyl-pyrazol-3-yl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[4-(3-bromophenyl)-5-methyl-2-phenyl-3-pyrazolyl]amino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[[4-(3-bromophenyl)-5-methyl-2-phenylpyrazol-3-yl]amino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[[4-(3-bromophenyl)-5-methyl-2-phenyl-pyrazol-3-yl]amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C23H17BrN4O3 MolecularWeight: 477.31008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C2=CC(=CC=C2)Br)NC=C3C=C(C=CC3=O)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1C2=CC(=CC=C2)Br)NC=C3C=C(C=CC3=O)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C23H17BrN4O3/c1-15-22(16-6-5-7-18(24)12-16)23(27(26-15)19-8-3-2-4-9-19)25-14-17-13-20(28(30)31)10-11-21(17)29/h2-14,25H,1H3