[4-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-yl-methanolate

Systemtic Name: [4-[2-chloranyl-5-(trifluoromethyl)phenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-yl-methanolate Openeye Name: [4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-yl-methanolate CAS Name: [4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonylimino-1-cyclohexa-2,5-dienylidene]-(1-pyrrolidinyl)methanolate IUPAC Name: [4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-ylmethanolate Traditional Name: [4-[2-chloro-5-(trifluoromethyl)phenyl]sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidino-methanolate Formula: C18H15ClF3N2O3S- MolecularWeight: 431.83651

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=C2C=CC(=NS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)C=C2)[O-]

Isomeric SMILES

C1CCN(C1)C(=C2C=CC(=NS(=O)(=O)C3=C(C=CC(=C3)C(F)(F)F)Cl)C=C2)[O-]

InChI

InChI=1S/C18H16ClF3N2O3S/c19-15-8-5-13(18(20,21)22)11-16(15)28(26,27)23-14-6-3-12(4-7-14)17(25)24-9-1-2-10-24/h3-8,11,25H,1-2,9-10H2/p-1