(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(3,4-dimethylphenyl)carbonylamino]ethanoate

Systemtic Name: (7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 2-[(3,4-dimethylphenyl)carbonylamino]ethanoate Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl 2-[(3,4-dimethylbenzoyl)amino]acetate CAS Name: 2-[[(3,4-dimethylphenyl)-oxomethyl]amino]acetic acid (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl 2-[(3,4-dimethylbenzoyl)amino]acetate Traditional Name: 2-[(3,4-dimethylbenzoyl)amino]acetic acid (7-hydroxy-2-keto-chromen-4-yl)methyl ester Formula: C21H19NO6 MolecularWeight: 381.37866

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=CC(=O)OC3=C2C=CC(=C3)O)C

InChI

InChI=1S/C21H19NO6/c1-12-3-4-14(7-13(12)2)21(26)22-10-20(25)27-11-15-8-19(24)28-18-9-16(23)5-6-17(15)18/h3-9,23H,10-11H2,1-2H3,(H,22,26)