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4-[[2-[[(5-nitro-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]phenoxy]methyl]benzoic acid

4-[[2-[[(5-nitro-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]phenoxy]methyl]benzoic acid

Systemtic Name:4-[[2-[[(5-nitro-1-benzothiophen-2-yl)carbonylhydrazinylidene]methyl]phenoxy]methyl]benzoic acid
Openeye Name:4-[[2-[[(5-nitrobenzothiophene-2-carbonyl)hydrazono]methyl]phenoxy]methyl]benzoic acid
CAS Name:4-[[2-[[[(5-nitro-1-benzothiophen-2-yl)-oxomethyl]hydrazinylidene]methyl]phenoxy]methyl]benzoic acid
IUPAC Name:4-[[2-[[(5-nitro-1-benzothiophene-2-carbonyl)hydrazinylidene]methyl]phenoxy]methyl]benzoic acid
Traditional Name:4-[[2-[[(5-nitrobenzothiophene-2-carbonyl)hydrazono]methyl]phenoxy]methyl]benzoic acid
Formula: C24H17N3O6S
MolecularWeight: 475.47328
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC4=CC=C(C=C4)C(=O)O


Isomeric SMILES

C1=CC=C(C(=C1)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])OCC4=CC=C(C=C4)C(=O)O


InChI

InChI=1S/C24H17N3O6S/c28-23(22-12-18-11-19(27(31)32)9-10-21(18)34-22)26-25-13-17-3-1-2-4-20(17)33-14-15-5-7-16(8-6-15)24(29)30/h1-13H,14H2,(H,26,28)(H,29,30)


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