(4-butyl-8-methyl-2-oxidanylidene-chromen-7-yl) 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: (4-butyl-8-methyl-2-oxidanylidene-chromen-7-yl) 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: (4-butyl-8-methyl-2-oxo-chromen-7-yl) 3-(tert-butoxycarbonylamino)propanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (4-butyl-8-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-butyl-8-methyl-2-oxochromen-7-yl) 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(tert-butoxycarbonylamino)propionic acid (4-butyl-2-keto-8-methyl-chromen-7-yl) ester Formula: C22H29NO6 MolecularWeight: 403.46876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)CCNC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=CC(=O)OC2=C1C=CC(=C2C)OC(=O)CCNC(=O)OC(C)(C)C

InChI

InChI=1S/C22H29NO6/c1-6-7-8-15-13-19(25)28-20-14(2)17(10-9-16(15)20)27-18(24)11-12-23-21(26)29-22(3,4)5/h9-10,13H,6-8,11-12H2,1-5H3,(H,23,26)