(2S)-2-[(8-methoxy-2-oxidanylidene-chromen-3-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: (2S)-2-[(8-methoxy-2-oxidanylidene-chromen-3-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: (2S)-2-[(8-methoxy-2-oxo-chromene-3-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: (2S)-2-[[(8-methoxy-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: (2S)-2-[(8-methoxy-2-oxochromene-3-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: (2S)-2-[(2-keto-8-methoxy-chromene-3-carbonyl)amino]-4-(methylthio)butyric acid Formula: C16H17NO6S MolecularWeight: 351.37428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

COC1=CC=CC2=C1OC(=O)C(=C2)C(=O)N[C@@H](CCSC)C(=O)O

InChI

InChI=1S/C16H17NO6S/c1-22-12-5-3-4-9-8-10(16(21)23-13(9)12)14(18)17-11(15(19)20)6-7-24-2/h3-5,8,11H,6-7H2,1-2H3,(H,17,18)(H,19,20)/t11-/m0/s1