4-chloranyl-2-(pentanoylamino)benzoate

Systemtic Name: 4-chloranyl-2-(pentanoylamino)benzoate Openeye Name: 4-chloro-2-(pentanoylamino)benzoate CAS Name: 4-chloro-2-(1-oxopentylamino)benzoate IUPAC Name: 4-chloro-2-(pentanoylamino)benzoate Traditional Name: 4-chloro-2-(valerylamino)benzoate Formula: C12H13ClNO3- MolecularWeight: 254.68952

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=CC(=C1)Cl)C(=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=C(C=CC(=C1)Cl)C(=O)[O-]

InChI

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