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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C(=O)O)NC(=O)C2(CCC3=CC=CC=C3C2)CS

Isomeric SMILES

C1CCC(CC1)(C(=O)O)NC(=O)C2(CCC3=CC=CC=C3C2)CS

InChI

InChI=1S/C19H25NO3S/c21-16(20-19(17(22)23)9-4-1-5-10-19)18(13-24)11-8-14-6-2-3-7-15(14)12-18/h2-3,6-7,24H,1,4-5,8-13H2,(H,20,21)(H,22,23)