(6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (6-chloranyl-4-methyl-2-oxidanylidene-chromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (6-chloro-4-methyl-2-oxo-chromen-7-yl) 2-(tert-butoxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(methylthio)butanoic acid (6-chloro-4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-4-methyl-2-oxochromen-7-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate Traditional Name: 2-(tert-butoxycarbonylamino)-4-(methylthio)butyric acid (6-chloro-2-keto-4-methyl-chromen-7-yl) ester Formula: C20H24ClNO6S MolecularWeight: 441.92566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CCSC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CCSC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C20H24ClNO6S/c1-11-8-17(23)26-15-10-16(13(21)9-12(11)15)27-18(24)14(6-7-29-5)22-19(25)28-20(2,3)4/h8-10,14H,6-7H2,1-5H3,(H,22,25)