3-azanyl-2-[2-(4-chlorophenyl)ethynyl]benzoic acid

Systemtic Name: 3-azanyl-2-[2-(4-chlorophenyl)ethynyl]benzoic acid Openeye Name: 3-amino-2-[2-(4-chlorophenyl)ethynyl]benzoic acid CAS Name: 3-amino-2-[2-(4-chlorophenyl)ethynyl]benzoic acid IUPAC Name: 3-amino-2-[2-(4-chlorophenyl)ethynyl]benzoic acid Traditional Name: 3-amino-2-[2-(4-chlorophenyl)ethynyl]benzoic acid Formula: C15H10ClNO2 MolecularWeight: 271.6984

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)N)C#CC2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

C1=CC(=C(C(=C1)N)C#CC2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C15H10ClNO2/c16-11-7-4-10(5-8-11)6-9-12-13(15(18)19)2-1-3-14(12)17/h1-5,7-8H,17H2,(H,18,19)