[3-bromanyl-6-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylimino-cyclohexa-2,4-dien-1-ylidene]-methoxy-methanolate

Systemtic Name: [3-bromanyl-6-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]sulfonylimino-cyclohexa-2,4-dien-1-ylidene]-methoxy-methanolate Openeye Name: [3-bromo-6-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylimino-cyclohexa-2,4-dien-1-ylidene]-methoxy-methanolate CAS Name: [3-bromo-6-[4-(2-oxo-1-pyrrolidinyl)phenyl]sulfonylimino-1-cyclohexa-2,4-dienylidene]-methoxymethanolate IUPAC Name: [3-bromo-6-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonyliminocyclohexa-2,4-dien-1-ylidene]-methoxymethanolate Traditional Name: [3-bromo-6-[4-(2-ketopyrrolidino)phenyl]sulfonylimino-cyclohexa-2,4-dien-1-ylidene]-methoxy-methanolate Formula: C18H16BrN2O5S- MolecularWeight: 452.29904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C1C=C(C=CC1=NS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)Br)[O-]

Isomeric SMILES

COC(=C1C=C(C=CC1=NS(=O)(=O)C2=CC=C(C=C2)N3CCCC3=O)Br)[O-]

InChI

InChI=1S/C18H17BrN2O5S/c1-26-18(23)15-11-12(19)4-9-16(15)20-27(24,25)14-7-5-13(6-8-14)21-10-2-3-17(21)22/h4-9,11,23H,2-3,10H2,1H3/p-1