2-(3-naphthalen-2-ylpropa-1,2-dienylsulfanyl)benzoic acid

Systemtic Name: 2-(3-naphthalen-2-ylpropa-1,2-dienylsulfanyl)benzoic acid Openeye Name: 2-[3-(2-naphthyl)propa-1,2-dienylsulfanyl]benzoic acid CAS Name: 2-[3-(2-naphthalenyl)propa-1,2-dienylthio]benzoic acid IUPAC Name: 2-(3-naphthalen-2-ylpropa-1,2-dienylsulfanyl)benzoic acid Traditional Name: 2-[3-(2-naphthyl)propa-1,2-dienylthio]benzoic acid Formula: C20H14O2S MolecularWeight: 318.38896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C=C=CSC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C=C=CSC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C20H14O2S/c21-20(22)18-9-3-4-10-19(18)23-13-5-6-15-11-12-16-7-1-2-8-17(16)14-15/h1-4,6-14H,(H,21,22)