(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-cyanophenoxy)ethanoate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-(4-cyanophenoxy)ethanoate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 2-(4-cyanophenoxy)acetate CAS Name: 2-(4-cyanophenoxy)acetic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 2-(4-cyanophenoxy)acetate Traditional Name: 2-(4-cyanophenoxy)acetic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H17NO5 MolecularWeight: 363.36338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)COC3=CC=C(C=C3)C#N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)COC3=CC=C(C=C3)C#N)C

InChI

InChI=1S/C21H17NO5/c1-13-7-18-16(9-20(23)27-19(18)8-14(13)2)11-26-21(24)12-25-17-5-3-15(10-22)4-6-17/h3-9H,11-12H2,1-2H3