6-[(5S)-5-(4-bromophenyl)-1-(phenylcarbonyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(5S)-5-(4-bromophenyl)-1-(phenylcarbonyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[(5S)-1-benzoyl-5-(4-bromophenyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(5S)-1-benzoyl-5-(4-bromophenyl)-3-pyrazolidinylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(5S)-1-benzoyl-5-(4-bromophenyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(5S)-1-benzoyl-5-(4-bromophenyl)pyrazolidin-3-ylidene]cyclohexa-2,4-dien-1-one Formula: C22H17BrN2O2 MolecularWeight: 421.28658

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(NC1=C2C=CC=CC2=O)C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

C1[C@H](N(NC1=C2C=CC=CC2=O)C(=O)C3=CC=CC=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2O2/c23-17-12-10-15(11-13-17)20-14-19(18-8-4-5-9-21(18)26)24-25(20)22(27)16-6-2-1-3-7-16/h1-13,20,24H,14H2/t20-/m0/s1