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

Systemtic Name: 6-[[(4-morpholin-4-ylsulfonylphenyl)methylamino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[(4-morpholinosulfonylphenyl)methylamino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[4-(4-morpholinylsulfonyl)phenyl]methylamino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[(4-morpholin-4-ylsulfonylphenyl)methylamino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[[(4-morpholinosulfonylbenzyl)amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19N3O6S/c22-18-6-3-16(21(23)24)11-15(18)13-19-12-14-1-4-17(5-2-14)28(25,26)20-7-9-27-10-8-20/h1-6,11,13,19H,7-10,12H2