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4,5-dimethoxy-2-[[4-(pentanoylamino)phenyl]carbonylamino]benzoic acid

4,5-dimethoxy-2-[[4-(pentanoylamino)phenyl]carbonylamino]benzoic acid

Systemtic Name:4,5-dimethoxy-2-[[4-(pentanoylamino)phenyl]carbonylamino]benzoic acid
Openeye Name:4,5-dimethoxy-2-[[4-(pentanoylamino)benzoyl]amino]benzoic acid
CAS Name:4,5-dimethoxy-2-[[oxo-[4-(1-oxopentylamino)phenyl]methyl]amino]benzoic acid
IUPAC Name:4,5-dimethoxy-2-[[4-(pentanoylamino)benzoyl]amino]benzoic acid
Traditional Name:4,5-dimethoxy-2-[[4-(valerylamino)benzoyl]amino]benzoic acid
Formula: C21H24N2O6
MolecularWeight: 400.42506
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2C(=O)O)OC)OC


Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)C(=O)NC2=CC(=C(C=C2C(=O)O)OC)OC


InChI

InChI=1S/C21H24N2O6/c1-4-5-6-19(24)22-14-9-7-13(8-10-14)20(25)23-16-12-18(29-3)17(28-2)11-15(16)21(26)27/h7-12H,4-6H2,1-3H3,(H,22,24)(H,23,25)(H,26,27)


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