2-[3-(5-chloranyl-6-oxidanyl-naphthalen-2-yl)propanoylamino]benzoic acid

Systemtic Name: 2-[3-(5-chloranyl-6-oxidanyl-naphthalen-2-yl)propanoylamino]benzoic acid Openeye Name: 2-[3-(5-chloro-6-hydroxy-2-naphthyl)propanoylamino]benzoic acid CAS Name: 2-[[3-(5-chloro-6-hydroxy-2-naphthalenyl)-1-oxopropyl]amino]benzoic acid IUPAC Name: 2-[3-(5-chloro-6-hydroxynaphthalen-2-yl)propanoylamino]benzoic acid Traditional Name: 2-[3-(5-chloro-6-hydroxy-2-naphthyl)propanoylamino]benzoic acid Formula: C20H16ClNO4 MolecularWeight: 369.79834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC3=C(C=C2)C(=C(C=C3)O)Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)CCC2=CC3=C(C=C2)C(=C(C=C3)O)Cl

InChI

InChI=1S/C20H16ClNO4/c21-19-14-8-5-12(11-13(14)7-9-17(19)23)6-10-18(24)22-16-4-2-1-3-15(16)20(25)26/h1-5,7-9,11,23H,6,10H2,(H,22,24)(H,25,26)