2-(3-naphthalen-2-ylpropylsulfanylmethyl)-2-oxidanyl-butanedioic acid

Systemtic Name: 2-(3-naphthalen-2-ylpropylsulfanylmethyl)-2-oxidanyl-butanedioic acid Openeye Name: 2-hydroxy-2-[3-(2-naphthyl)propylsulfanylmethyl]butanedioic acid CAS Name: 2-hydroxy-2-[[3-(2-naphthalenyl)propylthio]methyl]butanedioic acid IUPAC Name: 2-hydroxy-2-(3-naphthalen-2-ylpropylsulfanylmethyl)butanedioic acid Traditional Name: 2-hydroxy-2-[[3-(2-naphthyl)propylthio]methyl]succinic acid Formula: C18H20O5S MolecularWeight: 348.4134

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CCCSCC(CC(=O)O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CCCSCC(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C18H20O5S/c19-16(20)11-18(23,17(21)22)12-24-9-3-4-13-7-8-14-5-1-2-6-15(14)10-13/h1-2,5-8,10,23H,3-4,9,11-12H2,(H,19,20)(H,21,22)