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

Systemtic Name: 3-[[2-(tert-butylsulfanylmethyl)-3,4-dihydro-1H-naphthalen-2-yl]carbonylamino]propanoic acid Openeye Name: 3-[[2-(tert-butylsulfanylmethyl)tetralin-2-carbonyl]amino]propanoic acid CAS Name: 3-[[[2-[(tert-butylthio)methyl]-3,4-dihydro-1H-naphthalen-2-yl]-oxomethyl]amino]propanoic acid IUPAC Name: 3-[[2-(tert-butylsulfanylmethyl)-3,4-dihydro-1H-naphthalene-2-carbonyl]amino]propanoic acid Traditional Name: 3-[[2-[(tert-butylthio)methyl]tetralin-2-carbonyl]amino]propionic acid Formula: C19H27NO3S MolecularWeight: 349.48758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H27NO3S/c1-18(2,3)24-13-19(17(23)20-11-9-16(21)22)10-8-14-6-4-5-7-15(14)12-19/h4-7H,8-13H2,1-3H3,(H,20,23)(H,21,22)