(7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 3-(2-methylphenoxy)propanoate

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 3-(2-methylphenoxy)propanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 3-(2-methylphenoxy)propanoate CAS Name: 3-(2-methylphenoxy)propanoic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 3-(2-methylphenoxy)propanoate Traditional Name: 3-(2-methylphenoxy)propionic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C22H21NO6 MolecularWeight: 395.40524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1OCCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)NC(=O)C

InChI

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