2-[[2-(tert-butylsulfanylmethyl)-3,4-dihydro-1H-naphthalen-2-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[2-(tert-butylsulfanylmethyl)-3,4-dihydro-1H-naphthalen-2-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[2-(tert-butylsulfanylmethyl)tetralin-2-carbonyl]amino]acetic acid CAS Name: 2-[[[2-[(tert-butylthio)methyl]-3,4-dihydro-1H-naphthalen-2-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[2-(tert-butylsulfanylmethyl)-3,4-dihydro-1H-naphthalene-2-carbonyl]amino]acetic acid Traditional Name: 2-[[2-[(tert-butylthio)methyl]tetralin-2-carbonyl]amino]acetic acid Formula: C18H25NO3S MolecularWeight: 335.461

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC1(CCC2=CC=CC=C2C1)C(=O)NCC(=O)O

Isomeric SMILES

CC(C)(C)SCC1(CCC2=CC=CC=C2C1)C(=O)NCC(=O)O

InChI

InChI=1S/C18H25NO3S/c1-17(2,3)23-12-18(16(22)19-11-15(20)21)9-8-13-6-4-5-7-14(13)10-18/h4-7H,8-12H2,1-3H3,(H,19,22)(H,20,21)