(3-cyanophenyl)methyl 6-chloranyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: (3-cyanophenyl)methyl 6-chloranyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: (3-cyanophenyl)methyl 6-chloro-4-oxo-chromene-2-carboxylate CAS Name: 6-chloro-4-oxo-1-benzopyran-2-carboxylic acid (3-cyanophenyl)methyl ester IUPAC Name: (3-cyanophenyl)methyl 6-chloro-4-oxochromene-2-carboxylate Traditional Name: 6-chloro-4-keto-chromene-2-carboxylic acid (3-cyanobenzyl) ester Formula: C18H10ClNO4 MolecularWeight: 339.7293

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)COC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)COC(=O)C2=CC(=O)C3=C(O2)C=CC(=C3)Cl)C#N

InChI

InChI=1S/C18H10ClNO4/c19-13-4-5-16-14(7-13)15(21)8-17(24-16)18(22)23-10-12-3-1-2-11(6-12)9-20/h1-8H,10H2