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

Systemtic Name: (7-acetamido-2-oxidanylidene-chromen-4-yl)methyl 2-(4-chloranylphenoxy)-2-methyl-propanoate Openeye Name: (7-acetamido-2-oxo-chromen-4-yl)methyl 2-(4-chlorophenoxy)-2-methyl-propanoate CAS Name: 2-(4-chlorophenoxy)-2-methylpropanoic acid (7-acetamido-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-acetamido-2-oxochromen-4-yl)methyl 2-(4-chlorophenoxy)-2-methylpropanoate Traditional Name: 2-(4-chlorophenoxy)-2-methyl-propionic acid (7-acetamido-2-keto-chromen-4-yl)methyl ester Formula: C22H20ClNO6 MolecularWeight: 429.8503

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H20ClNO6/c1-13(25)24-16-6-9-18-14(10-20(26)29-19(18)11-16)12-28-21(27)22(2,3)30-17-7-4-15(23)5-8-17/h4-11H,12H2,1-3H3,(H,24,25)