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

Systemtic Name: (6E)-4-chloranyl-6-[[(3-morpholin-4-ylsulfonylphenyl)amino]methylidene]-2-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-chloro-6-[(3-morpholinosulfonylanilino)methylene]-2-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-chloro-6-[[3-(4-morpholinylsulfonyl)anilino]methylidene]-2-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-chloro-6-[(3-morpholin-4-ylsulfonylanilino)methylidene]-2-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-chloro-6-[(3-morpholinosulfonylanilino)methylene]-2-nitro-cyclohexa-2,4-dien-1-one Formula: C17H16ClN3O6S MolecularWeight: 425.84344

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)N/C=C/3\C=C(C=C(C3=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H16ClN3O6S/c18-13-8-12(17(22)16(9-13)21(23)24)11-19-14-2-1-3-15(10-14)28(25,26)20-4-6-27-7-5-20/h1-3,8-11,19H,4-7H2/b12-11+