6-[[(3-morpholin-4-ylsulfonylphenyl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[(3-morpholin-4-ylsulfonylphenyl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(3-morpholinosulfonylanilino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[3-(4-morpholinylsulfonyl)anilino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(3-morpholin-4-ylsulfonylanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[(3-morpholinosulfonylanilino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C17H17N3O6S MolecularWeight: 391.39838

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC=C3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC=C3C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O6S/c21-17-5-4-15(20(22)23)10-13(17)12-18-14-2-1-3-16(11-14)27(24,25)19-6-8-26-9-7-19/h1-5,10-12,18H,6-9H2