[4-(4-chloranyl-3-nitro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-yl-methanolate

Systemtic Name: [4-(4-chloranyl-3-nitro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-yl-methanolate Openeye Name: [4-(4-chloro-3-nitro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-yl-methanolate CAS Name: [4-(4-chloro-3-nitrophenyl)sulfonylimino-1-cyclohexa-2,5-dienylidene]-(1-pyrrolidinyl)methanolate IUPAC Name: [4-(4-chloro-3-nitrophenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidin-1-ylmethanolate Traditional Name: [4-(4-chloro-3-nitro-phenyl)sulfonyliminocyclohexa-2,5-dien-1-ylidene]-pyrrolidino-methanolate Formula: C17H15ClN3O5S- MolecularWeight: 408.8361

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O5S/c18-15-8-7-14(11-16(15)21(23)24)27(25,26)19-13-5-3-12(4-6-13)17(22)20-9-1-2-10-20/h3-8,11,22H,1-2,9-10H2/p-1