(8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-cyanobenzoate

Systemtic Name: (8-methyl-7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl 4-cyanobenzoate Openeye Name: (7-hydroxy-8-methyl-2-oxo-chromen-4-yl)methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (7-hydroxy-8-methyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-hydroxy-8-methyl-2-oxochromen-4-yl)methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (7-hydroxy-2-keto-8-methyl-chromen-4-yl)methyl ester Formula: C19H13NO5 MolecularWeight: 335.31022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3=CC=C(C=C3)C#N)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2COC(=O)C3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C19H13NO5/c1-11-16(21)7-6-15-14(8-17(22)25-18(11)15)10-24-19(23)13-4-2-12(9-20)3-5-13/h2-8,21H,10H2,1H3