6-(2,2-dimethoxyethyl)-5-nitro-1-benzothiophene

Systemtic Name: 6-(2,2-dimethoxyethyl)-5-nitro-1-benzothiophene Openeye Name: 6-(2,2-dimethoxyethyl)-5-nitro-benzothiophene CAS Name: 6-(2,2-dimethoxyethyl)-5-nitro-1-benzothiophene IUPAC Name: 6-(2,2-dimethoxyethyl)-5-nitro-1-benzothiophene Traditional Name: 6-(2,2-dimethoxyethyl)-5-nitro-benzothiophene Formula: C12H13NO4S MolecularWeight: 267.30092

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=C(C=C2C=CSC2=C1)[N+](=O)[O-])OC

Isomeric SMILES

COC(CC1=C(C=C2C=CSC2=C1)[N+](=O)[O-])OC

InChI

InChI=1S/C12H13NO4S/c1-16-12(17-2)7-9-6-11-8(3-4-18-11)5-10(9)13(14)15/h3-6,12H,7H2,1-2H3