8-[8-(hydroxymethyl)naphthalen-1-yl]sulfanylnaphthalene-1-carboxylic acid

Systemtic Name: 8-[8-(hydroxymethyl)naphthalen-1-yl]sulfanylnaphthalene-1-carboxylic acid Openeye Name: 8-[[8-(hydroxymethyl)-1-naphthyl]sulfanyl]naphthalene-1-carboxylic acid CAS Name: 8-[[8-(hydroxymethyl)-1-naphthalenyl]thio]-1-naphthalenecarboxylic acid IUPAC Name: 8-[8-(hydroxymethyl)naphthalen-1-yl]sulfanylnaphthalene-1-carboxylic acid Traditional Name: 8-[(8-methylol-1-naphthyl)thio]-1-naphthoic acid Formula: C22H16O3S MolecularWeight: 360.42564

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CO)C(=CC=C2)SC3=CC=CC4=C3C(=CC=C4)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)CO)C(=CC=C2)SC3=CC=CC4=C3C(=CC=C4)C(=O)O

InChI

InChI=1S/C22H16O3S/c23-13-16-9-1-5-14-7-3-11-18(20(14)16)26-19-12-4-8-15-6-2-10-17(21(15)19)22(24)25/h1-12,23H,13H2,(H,24,25)