5-chloranyl-2-methoxy-4-(pentanoylamino)benzoic acid

Systemtic Name: 5-chloranyl-2-methoxy-4-(pentanoylamino)benzoic acid Openeye Name: 5-chloro-2-methoxy-4-(pentanoylamino)benzoic acid CAS Name: 5-chloro-2-methoxy-4-(1-oxopentylamino)benzoic acid IUPAC Name: 5-chloro-2-methoxy-4-(pentanoylamino)benzoic acid Traditional Name: 5-chloro-2-methoxy-4-(valerylamino)benzoic acid Formula: C13H16ClNO4 MolecularWeight: 285.72344

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C(=C1)OC)C(=O)O)Cl

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C(=C1)OC)C(=O)O)Cl

InChI

InChI=1S/C13H16ClNO4/c1-3-4-5-12(16)15-10-7-11(19-2)8(13(17)18)6-9(10)14/h6-7H,3-5H2,1-2H3,(H,15,16)(H,17,18)