3-[(3-chlorophenyl)-propanoyl-amino]propanoate

Systemtic Name: 3-[(3-chlorophenyl)-propanoyl-amino]propanoate Openeye Name: 3-(3-chloro-N-propanoyl-anilino)propanoate CAS Name: 3-[3-chloro-N-(1-oxopropyl)anilino]propanoate IUPAC Name: 3-(3-chloro-N-propanoylanilino)propanoate Traditional Name: 3-(3-chloro-N-propionyl-anilino)propionate Formula: C12H13ClNO3- MolecularWeight: 254.68952

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CCC(=O)[O-])C1=CC(=CC=C1)Cl

Isomeric SMILES

CCC(=O)N(CCC(=O)[O-])C1=CC(=CC=C1)Cl

InChI

InChI=1S/C12H14ClNO3/c1-2-11(15)14(7-6-12(16)17)10-5-3-4-9(13)8-10/h3-5,8H,2,6-7H2,1H3,(H,16,17)/p-1