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

Systemtic Name: 6-[[(4-methyl-3-morpholin-4-ylsulfonyl-phenyl)amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: 6-[(4-methyl-3-morpholinosulfonyl-anilino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: 6-[[4-methyl-3-(4-morpholinylsulfonyl)anilino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(4-methyl-3-morpholin-4-ylsulfonylanilino)methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: 6-[(4-methyl-3-morpholinosulfonyl-anilino)methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C18H19N3O6S MolecularWeight: 405.42496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC=C2C=C(C=CC2=O)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC=C2C=C(C=CC2=O)[N+](=O)[O-])S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H19N3O6S/c1-13-2-3-15(11-18(13)28(25,26)20-6-8-27-9-7-20)19-12-14-10-16(21(23)24)4-5-17(14)22/h2-5,10-12,19H,6-9H2,1H3