(6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 4-cyanobenzoate

Systemtic Name: (6-chloranyl-7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 4-cyanobenzoate Openeye Name: (6-chloro-7-ethyl-2-oxo-chromen-4-yl)methyl 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid (6-chloro-7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6-chloro-7-ethyl-2-oxochromen-4-yl)methyl 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid (6-chloro-7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C20H14ClNO4 MolecularWeight: 367.78246

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)C#N)Cl

Isomeric SMILES

CCC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=CC=C(C=C3)C#N)Cl

InChI

InChI=1S/C20H14ClNO4/c1-2-13-7-18-16(9-17(13)21)15(8-19(23)26-18)11-25-20(24)14-5-3-12(10-22)4-6-14/h3-9H,2,11H2,1H3