(4-oxidanylidene-3-phenoxy-chromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate

Systemtic Name: (4-oxidanylidene-3-phenoxy-chromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Openeye Name: (4-oxo-3-phenoxy-chromen-7-yl) 2-(benzyloxycarbonylamino)-3-methyl-butanoate CAS Name: 3-methyl-2-(phenylmethoxycarbonylamino)butanoic acid (4-oxo-3-phenoxy-1-benzopyran-7-yl) ester IUPAC Name: (4-oxo-3-phenoxychromen-7-yl) 3-methyl-2-(phenylmethoxycarbonylamino)butanoate Traditional Name: 2-(benzyloxycarbonylamino)-3-methyl-butyric acid (4-keto-3-phenoxy-chromen-7-yl) ester Formula: C28H25NO7 MolecularWeight: 487.5006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)C(C(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)OC3=CC=CC=C3)NC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C28H25NO7/c1-18(2)25(29-28(32)34-16-19-9-5-3-6-10-19)27(31)36-21-13-14-22-23(15-21)33-17-24(26(22)30)35-20-11-7-4-8-12-20/h3-15,17-18,25H,16H2,1-2H3,(H,29,32)