(2S)-2-[2-(7-methoxy-4,8-dimethyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[2-(7-methoxy-4,8-dimethyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[2-(7-methoxy-4,8-dimethyl-2-oxo-chromen-3-yl)acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-(7-methoxy-4,8-dimethyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[2-(7-methoxy-4,8-dimethyl-2-oxochromen-3-yl)acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[2-(2-keto-7-methoxy-4,8-dimethyl-chromen-3-yl)acetyl]amino]-4-(methylthio)butyrate Formula: C19H22NO6S- MolecularWeight: 392.44608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC)CC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OC)CC(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C19H23NO6S/c1-10-12-5-6-15(25-3)11(2)17(12)26-19(24)13(10)9-16(21)20-14(18(22)23)7-8-27-4/h5-6,14H,7-9H2,1-4H3,(H,20,21)(H,22,23)/p-1/t14-/m0/s1