3-[4-methyl-1-oxidanyl-2-(phenylmethoxycarbonylamino)pentyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[4-methyl-1-oxidanyl-2-(phenylmethoxycarbonylamino)pentyl]thiophene-2-carboxylic acid Openeye Name: 3-[2-(benzyloxycarbonylamino)-1-hydroxy-4-methyl-pentyl]thiophene-2-carboxylic acid CAS Name: 3-[1-hydroxy-4-methyl-2-(phenylmethoxycarbonylamino)pentyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[1-hydroxy-4-methyl-2-(phenylmethoxycarbonylamino)pentyl]thiophene-2-carboxylic acid Traditional Name: 3-[2-(benzyloxycarbonylamino)-1-hydroxy-4-methyl-pentyl]-2-thenoic acid Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C1=C(SC=C1)C(=O)O)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(C1=C(SC=C1)C(=O)O)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H23NO5S/c1-12(2)10-15(16(21)14-8-9-26-17(14)18(22)23)20-19(24)25-11-13-6-4-3-5-7-13/h3-9,12,15-16,21H,10-11H2,1-2H3,(H,20,24)(H,22,23)