2-methyl-2-[2-oxidanylidene-3-(phenethylcarbamoyl)chromen-7-yl]oxy-propanoate

Systemtic Name: 2-methyl-2-[2-oxidanylidene-3-(phenethylcarbamoyl)chromen-7-yl]oxy-propanoate Openeye Name: 2-methyl-2-[2-oxo-3-(phenethylcarbamoyl)chromen-7-yl]oxy-propanoate CAS Name: 2-methyl-2-[[2-oxo-3-[oxo-(phenethylamino)methyl]-1-benzopyran-7-yl]oxy]propanoate IUPAC Name: 2-methyl-2-[2-oxo-3-(phenethylcarbamoyl)chromen-7-yl]oxypropanoate Traditional Name: 2-[2-keto-3-(phenethylcarbamoyl)chromen-7-yl]oxy-2-methyl-propionate Formula: C22H20NO6- MolecularWeight: 394.3973

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)[O-])OC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C(=O)[O-])OC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H21NO6/c1-22(2,21(26)27)29-16-9-8-15-12-17(20(25)28-18(15)13-16)19(24)23-11-10-14-6-4-3-5-7-14/h3-9,12-13H,10-11H2,1-2H3,(H,23,24)(H,26,27)/p-1