(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-(tert-butoxycarbonylamino)propanoate CAS Name: 3-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: 3-(tert-butoxycarbonylamino)propionic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C22H23NO6 MolecularWeight: 397.42112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)OCC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)OCC1=CC(=O)OC2=C1C3=CC=CC=C3C=C2

InChI

InChI=1S/C22H23NO6/c1-22(2,3)29-21(26)23-11-10-18(24)27-13-15-12-19(25)28-17-9-8-14-6-4-5-7-16(14)20(15)17/h4-9,12H,10-11,13H2,1-3H3,(H,23,26)