4-[5-(3-bromophenyl)-1-phenyl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(3-bromophenyl)-1-phenyl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(3-bromophenyl)-1-phenyl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-(3-bromophenyl)-1-phenyl-3-pyrazolidinylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(3-bromophenyl)-1-phenylpyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-(3-bromophenyl)-1-phenyl-pyrazolidin-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C21H17BrN2O MolecularWeight: 393.27648

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(NC1=C2C=CC(=O)C=C2)C3=CC=CC=C3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1C(N(NC1=C2C=CC(=O)C=C2)C3=CC=CC=C3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C21H17BrN2O/c22-17-6-4-5-16(13-17)21-14-20(15-9-11-19(25)12-10-15)23-24(21)18-7-2-1-3-8-18/h1-13,21,23H,14H2