4-chloranyl-2-[[4-(pentanoylamino)phenyl]carbonylamino]benzoic acid

Systemtic Name: 4-chloranyl-2-[[4-(pentanoylamino)phenyl]carbonylamino]benzoic acid Openeye Name: 4-chloro-2-[[4-(pentanoylamino)benzoyl]amino]benzoic acid CAS Name: 4-chloro-2-[[oxo-[4-(1-oxopentylamino)phenyl]methyl]amino]benzoic acid IUPAC Name: 4-chloro-2-[[4-(pentanoylamino)benzoyl]amino]benzoic acid Traditional Name: 4-chloro-2-[[4-(valerylamino)benzoyl]amino]benzoic acid Formula: C19H19ClN2O4 MolecularWeight: 374.81816

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)C(=O)O

Isomeric SMILES

CCCCC(=O)NC1=CC=C(C=C1)C(=O)NC2=C(C=CC(=C2)Cl)C(=O)O

InChI

InChI=1S/C19H19ClN2O4/c1-2-3-4-17(23)21-14-8-5-12(6-9-14)18(24)22-16-11-13(20)7-10-15(16)19(25)26/h5-11H,2-4H2,1H3,(H,21,23)(H,22,24)(H,25,26)