2-(3,4-dihydro-2H-chromen-3-ylcarbonylamino)-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-(3,4-dihydro-2H-chromen-3-ylcarbonylamino)-4-methylsulfanyl-butanoic acid Openeye Name: 2-(chromane-3-carbonylamino)-4-methylsulfanyl-butanoic acid CAS Name: 2-[[3,4-dihydro-2H-1-benzopyran-3-yl(oxo)methyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-(3,4-dihydro-2H-chromene-3-carbonylamino)-4-methylsulfanylbutanoic acid Traditional Name: 2-(chroman-3-carbonylamino)-4-(methylthio)butyric acid Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)O)NC(=O)C1CC2=CC=CC=C2OC1

Isomeric SMILES

CSCCC(C(=O)O)NC(=O)C1CC2=CC=CC=C2OC1

InChI

InChI=1S/C15H19NO4S/c1-21-7-6-12(15(18)19)16-14(17)11-8-10-4-2-3-5-13(10)20-9-11/h2-5,11-12H,6-9H2,1H3,(H,16,17)(H,18,19)