(2R)-4-methylsulfanyl-2-[(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)carbonylamino]butanoate

Systemtic Name: (2R)-4-methylsulfanyl-2-[(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-yl)carbonylamino]butanoate Openeye Name: (2R)-4-methylsulfanyl-2-[(2-methyl-4,5,6,7-tetrahydrobenzofuran-3-carbonyl)amino]butanoate CAS Name: (2R)-2-[[(2-methyl-4,5,6,7-tetrahydrobenzofuran-3-yl)-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-4-methylsulfanyl-2-[(2-methyl-4,5,6,7-tetrahydro-1-benzofuran-3-carbonyl)amino]butanoate Traditional Name: (2R)-2-[(2-methyl-4,5,6,7-tetrahydrobenzofuran-3-carbonyl)amino]-4-(methylthio)butyrate Formula: C15H20NO4S- MolecularWeight: 310.3886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)CCCC2)C(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC1=C(C2=C(O1)CCCC2)C(=O)N[C@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C15H21NO4S/c1-9-13(10-5-3-4-6-12(10)20-9)14(17)16-11(15(18)19)7-8-21-2/h11H,3-8H2,1-2H3,(H,16,17)(H,18,19)/p-1/t11-/m1/s1