2-(tert-butylsulfanylmethyl)-3-naphthalen-1-yl-propanoic acid

Systemtic Name: 2-(tert-butylsulfanylmethyl)-3-naphthalen-1-yl-propanoic acid Openeye Name: 2-(tert-butylsulfanylmethyl)-3-(1-naphthyl)propanoic acid CAS Name: 2-[(tert-butylthio)methyl]-3-(1-naphthalenyl)propanoic acid IUPAC Name: 2-(tert-butylsulfanylmethyl)-3-naphthalen-1-ylpropanoic acid Traditional Name: 2-[(tert-butylthio)methyl]-3-(1-naphthyl)propionic acid Formula: C18H22O2S MolecularWeight: 302.43108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(CC1=CC=CC2=CC=CC=C21)C(=O)O

Isomeric SMILES

CC(C)(C)SCC(CC1=CC=CC2=CC=CC=C21)C(=O)O

InChI

InChI=1S/C18H22O2S/c1-18(2,3)21-12-15(17(19)20)11-14-9-6-8-13-7-4-5-10-16(13)14/h4-10,15H,11-12H2,1-3H3,(H,19,20)