(7-methoxy-2-oxidanylidene-chromen-4-yl)methyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate

Systemtic Name: (7-methoxy-2-oxidanylidene-chromen-4-yl)methyl (2S)-3-methyl-2-(2-phenylethanoylamino)butanoate Openeye Name: (7-methoxy-2-oxo-chromen-4-yl)methyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate CAS Name: (2S)-3-methyl-2-[(1-oxo-2-phenylethyl)amino]butanoic acid (7-methoxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methoxy-2-oxochromen-4-yl)methyl (2S)-3-methyl-2-[(2-phenylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[(2-phenylacetyl)amino]butyric acid (2-keto-7-methoxy-chromen-4-yl)methyl ester Formula: C24H25NO6 MolecularWeight: 423.4584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)OC)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=CC(=O)OC2=C1C=CC(=C2)OC)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C24H25NO6/c1-15(2)23(25-21(26)11-16-7-5-4-6-8-16)24(28)30-14-17-12-22(27)31-20-13-18(29-3)9-10-19(17)20/h4-10,12-13,15,23H,11,14H2,1-3H3,(H,25,26)/t23-/m0/s1