methyl (2S)-2-[2-(2-oxidanylidenechromen-7-yl)oxyethanoylamino]-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-[2-(2-oxidanylidenechromen-7-yl)oxyethanoylamino]-3-phenyl-propanoate Openeye Name: methyl (2S)-2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[1-oxo-2-[(2-oxo-1-benzopyran-7-yl)oxy]ethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]-3-phenylpropanoate Traditional Name: (2S)-2-[[2-(2-ketochromen-7-yl)oxyacetyl]amino]-3-phenyl-propionic acid methyl ester Formula: C21H19NO6 MolecularWeight: 381.37866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=CC=C1)NC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3

Isomeric SMILES

COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3

InChI

InChI=1S/C21H19NO6/c1-26-21(25)17(11-14-5-3-2-4-6-14)22-19(23)13-27-16-9-7-15-8-10-20(24)28-18(15)12-16/h2-10,12,17H,11,13H2,1H3,(H,22,23)/t17-/m0/s1