(3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (3,4,7-trimethyl-2-oxidanylidene-chromen-5-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanyl-butanoate Openeye Name: (3,4,7-trimethyl-2-oxo-chromen-5-yl) 2-(tert-butoxycarbonylamino)-4-methylsulfanyl-butanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(methylthio)butanoic acid (3,4,7-trimethyl-2-oxo-1-benzopyran-5-yl) ester IUPAC Name: (3,4,7-trimethyl-2-oxochromen-5-yl) 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-methylsulfanylbutanoate Traditional Name: 2-(tert-butoxycarbonylamino)-4-(methylthio)butyric acid (2-keto-3,4,7-trimethyl-chromen-5-yl) ester Formula: C22H29NO6S MolecularWeight: 435.53376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)OC(=O)C(CCSC)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC2=C(C(=C(C(=O)O2)C)C)C(=C1)OC(=O)C(CCSC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C22H29NO6S/c1-12-10-16-18(13(2)14(3)19(24)27-16)17(11-12)28-20(25)15(8-9-30-7)23-21(26)29-22(4,5)6/h10-11,15H,8-9H2,1-7H3,(H,23,26)