(4-nitro-2-thiophen-2-yl-phenyl) 2,5-dimethoxybenzenesulfonate

Systemtic Name: (4-nitro-2-thiophen-2-yl-phenyl) 2,5-dimethoxybenzenesulfonate Openeye Name: [4-nitro-2-(2-thienyl)phenyl] 2,5-dimethoxybenzenesulfonate CAS Name: 2,5-dimethoxybenzenesulfonic acid (4-nitro-2-thiophen-2-ylphenyl) ester IUPAC Name: (4-nitro-2-thiophen-2-ylphenyl) 2,5-dimethoxybenzenesulfonate Traditional Name: 2,5-dimethoxybenzenesulfonic acid [4-nitro-2-(2-thienyl)phenyl] ester Formula: C18H15NO7S2 MolecularWeight: 421.4442

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CS3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C3=CC=CS3

InChI

InChI=1S/C18H15NO7S2/c1-24-13-6-8-16(25-2)18(11-13)28(22,23)26-15-7-5-12(19(20)21)10-14(15)17-4-3-9-27-17/h3-11H,1-2H3