[6-(2-methoxy-5-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-yl-methanolate

Systemtic Name: [6-(2-methoxy-5-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-yl-methanolate Openeye Name: [6-(2-methoxy-5-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholino-methanolate CAS Name: [6-(2-methoxy-5-nitrophenyl)sulfonylimino-1-cyclohexa-2,4-dienylidene]-(4-morpholinyl)methanolate IUPAC Name: [6-(2-methoxy-5-nitrophenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholin-4-ylmethanolate Traditional Name: [6-(2-methoxy-5-nitro-phenyl)sulfonyliminocyclohexa-2,4-dien-1-ylidene]-morpholino-methanolate Formula: C18H18N3O7S- MolecularWeight: 420.41642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N=C2C=CC=CC2=C(N3CCOCC3)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N=C2C=CC=CC2=C(N3CCOCC3)[O-]

InChI

InChI=1S/C18H19N3O7S/c1-27-16-7-6-13(21(23)24)12-17(16)29(25,26)19-15-5-3-2-4-14(15)18(22)20-8-10-28-11-9-20/h2-7,12,22H,8-11H2,1H3/p-1