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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CC)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OC(=O)C(CC)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H26ClNO6/c1-6-8-12-9-18(24)27-16-11-17(14(22)10-13(12)16)28-19(25)15(7-2)23-20(26)29-21(3,4)5/h9-11,15H,6-8H2,1-5H3,(H,23,26)