[6-(4-chloranyl-3-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-yl-methanolate

Systemtic Name: [6-(4-chloranyl-3-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-yl-methanolate Openeye Name: [6-(4-chloro-3-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholino-methanolate CAS Name: [6-(4-chloro-3-nitrophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]-(4-morpholinyl)methanolate IUPAC Name: [6-(4-chloro-3-nitrophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-ylmethanolate Traditional Name: [6-(4-chloro-3-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholino-methanolate Formula: C17H15ClN3O6S- MolecularWeight: 424.8355

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=C2C=CC=CC2=NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[O-]

Isomeric SMILES

C1COCCN1C(=C2C=CC=CC2=NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])[O-]

InChI

InChI=1S/C17H16ClN3O6S/c18-14-6-5-12(11-16(14)21(23)24)28(25,26)19-15-4-2-1-3-13(15)17(22)20-7-9-27-10-8-20/h1-6,11,22H,7-10H2/p-1