4-[6-(4-chlorophenyl)hex-5-ynylamino]benzoic acid

Systemtic Name: 4-[6-(4-chlorophenyl)hex-5-ynylamino]benzoic acid Openeye Name: 4-[6-(4-chlorophenyl)hex-5-ynylamino]benzoic acid CAS Name: 4-[6-(4-chlorophenyl)hex-5-ynylamino]benzoic acid IUPAC Name: 4-[6-(4-chlorophenyl)hex-5-ynylamino]benzoic acid Traditional Name: 4-[6-(4-chlorophenyl)hex-5-ynylamino]benzoic acid Formula: C19H18ClNO2 MolecularWeight: 327.80472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CCCCCNC2=CC=C(C=C2)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1C#CCCCCNC2=CC=C(C=C2)C(=O)O)Cl

InChI

InChI=1S/C19H18ClNO2/c20-17-10-6-15(7-11-17)5-3-1-2-4-14-21-18-12-8-16(9-13-18)19(22)23/h6-13,21H,1-2,4,14H2,(H,22,23)