4-[[2-(sulfanylmethyl)-3,4-dihydro-1H-naphthalen-2-yl]carbonylamino]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[2-(sulfanylmethyl)-3,4-dihydro-1H-naphthalen-2-yl]carbonylamino]cyclohexane-1-carboxylic acid Openeye Name: 4-[[2-(sulfanylmethyl)tetralin-2-carbonyl]amino]cyclohexanecarboxylic acid CAS Name: 4-[[[2-(mercaptomethyl)-3,4-dihydro-1H-naphthalen-2-yl]-oxomethyl]amino]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[2-(sulfanylmethyl)-3,4-dihydro-1H-naphthalene-2-carbonyl]amino]cyclohexane-1-carboxylic acid Traditional Name: 4-[[2-(mercaptomethyl)tetralin-2-carbonyl]amino]cyclohexanecarboxylic acid Formula: C19H25NO3S MolecularWeight: 347.4717

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1C(=O)O)NC(=O)C2(CCC3=CC=CC=C3C2)CS

Isomeric SMILES

C1CC(CCC1C(=O)O)NC(=O)C2(CCC3=CC=CC=C3C2)CS

InChI

InChI=1S/C19H25NO3S/c21-17(22)14-5-7-16(8-6-14)20-18(23)19(12-24)10-9-13-3-1-2-4-15(13)11-19/h1-4,14,16,24H,5-12H2,(H,20,23)(H,21,22)