4-chloranyl-3-(pentanoylamino)benzoic acid

Systemtic Name: 4-chloranyl-3-(pentanoylamino)benzoic acid Openeye Name: 4-chloro-3-(pentanoylamino)benzoic acid CAS Name: 4-chloro-3-(1-oxopentylamino)benzoic acid IUPAC Name: 4-chloro-3-(pentanoylamino)benzoic acid Traditional Name: 4-chloro-3-(valerylamino)benzoic acid Formula: C12H14ClNO3 MolecularWeight: 255.69746

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14ClNO3/c1-2-3-4-11(15)14-10-7-8(12(16)17)5-6-9(10)13/h5-7H,2-4H2,1H3,(H,14,15)(H,16,17)