4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-nitro-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-nitro-cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-nitro-cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-nitro-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-nitrocyclohexa-2,5-dien-1-one Traditional Name: 4-[2-(5-esyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-nitro-cyclohexa-2,5-dien-1-one Formula: C17H14N2O6S MolecularWeight: 374.36786

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=CC=C3C=CC(=O)C(=C3)[N+](=O)[O-])N2

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=CC=C3C=CC(=O)C(=C3)[N+](=O)[O-])N2

InChI

InChI=1S/C17H14N2O6S/c1-2-26(23,24)12-5-7-16-13(10-12)18-17(25-16)8-4-11-3-6-15(20)14(9-11)19(21)22/h3-10,18H,2H2,1H3