(6E)-6-[2-(2-chlorophenyl)-1H-pyrazol-3-ylidene]-3-oxidanyl-4-piperidin-1-ylsulfonyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[2-(2-chlorophenyl)-1H-pyrazol-3-ylidene]-3-oxidanyl-4-piperidin-1-ylsulfonyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[2-(2-chlorophenyl)-1H-pyrazol-3-ylidene]-3-hydroxy-4-(1-piperidylsulfonyl)cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[2-(2-chlorophenyl)-1H-pyrazol-3-ylidene]-3-hydroxy-4-(1-piperidinylsulfonyl)-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[2-(2-chlorophenyl)-1H-pyrazol-3-ylidene]-3-hydroxy-4-piperidin-1-ylsulfonylcyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[2-(2-chlorophenyl)-3-pyrazolin-3-ylidene]-3-hydroxy-4-piperidinosulfonyl-cyclohexa-2,4-dien-1-one Formula: C20H20ClN3O4S MolecularWeight: 433.9085

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C3C=CNN3C4=CC=CC=C4Cl)C(=O)C=C2O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C/C(=C\3/C=CNN3C4=CC=CC=C4Cl)/C(=O)C=C2O

InChI

InChI=1S/C20H20ClN3O4S/c21-15-6-2-3-7-17(15)24-16(8-9-22-24)14-12-20(19(26)13-18(14)25)29(27,28)23-10-4-1-5-11-23/h2-3,6-9,12-13,22,26H,1,4-5,10-11H2/b16-14+