4-[1-(2,4-dichlorophenyl)propylamino]benzoic acid

Systemtic Name: 4-[1-(2,4-dichlorophenyl)propylamino]benzoic acid Openeye Name: 4-[1-(2,4-dichlorophenyl)propylamino]benzoic acid CAS Name: 4-[1-(2,4-dichlorophenyl)propylamino]benzoic acid IUPAC Name: 4-[1-(2,4-dichlorophenyl)propylamino]benzoic acid Traditional Name: 4-[1-(2,4-dichlorophenyl)propylamino]benzoic acid Formula: C16H15Cl2NO2 MolecularWeight: 324.2018

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C=C(C=C1)Cl)Cl)NC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CCC(C1=C(C=C(C=C1)Cl)Cl)NC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C16H15Cl2NO2/c1-2-15(13-8-5-11(17)9-14(13)18)19-12-6-3-10(4-7-12)16(20)21/h3-9,15,19H,2H2,1H3,(H,20,21)