(6-chloranyl-4-ethyl-2-oxidanylidene-chromen-7-yl) 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate

Systemtic Name: (6-chloranyl-4-ethyl-2-oxidanylidene-chromen-7-yl) 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Openeye Name: (6-chloro-4-ethyl-2-oxo-chromen-7-yl) 2-(tert-butoxycarbonylamino)-3-methyl-butanoate CAS Name: 3-methyl-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]butanoic acid (6-chloro-4-ethyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (6-chloro-4-ethyl-2-oxochromen-7-yl) 3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoate Traditional Name: 2-(tert-butoxycarbonylamino)-3-methyl-butyric acid (6-chloro-4-ethyl-2-keto-chromen-7-yl) ester Formula: C21H26ClNO6 MolecularWeight: 423.88724

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(C(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(C(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H26ClNO6/c1-7-12-8-17(24)27-15-10-16(14(22)9-13(12)15)28-19(25)18(11(2)3)23-20(26)29-21(4,5)6/h8-11,18H,7H2,1-6H3,(H,23,26)