4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-methoxy-6-nitro-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-methoxy-6-nitro-cyclohexa-2,5-dien-1-one Openeye Name: 4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-methoxy-6-nitro-cyclohexa-2,5-dien-1-one CAS Name: 4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-methoxy-6-nitro-1-cyclohexa-2,5-dienone IUPAC Name: 4-[2-(5-ethylsulfonyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-methoxy-6-nitrocyclohexa-2,5-dien-1-one Traditional Name: 4-[2-(5-esyl-3H-1,3-benzoxazol-2-ylidene)ethylidene]-2-methoxy-6-nitro-cyclohexa-2,5-dien-1-one Formula: C18H16N2O7S MolecularWeight: 404.39384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O7S/c1-3-28(24,25)12-5-6-15-13(10-12)19-17(27-15)7-4-11-8-14(20(22)23)18(21)16(9-11)26-2/h4-10,19H,3H2,1-2H3