pentyl 6-(chloromethyl)-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: pentyl 6-(chloromethyl)-2-oxidanylidene-chromene-3-carboxylate Openeye Name: pentyl 6-(chloromethyl)-2-oxo-chromene-3-carboxylate CAS Name: 6-(chloromethyl)-2-oxo-1-benzopyran-3-carboxylic acid pentyl ester IUPAC Name: pentyl 6-(chloromethyl)-2-oxochromene-3-carboxylate Traditional Name: 6-(chloromethyl)-2-keto-chromene-3-carboxylic acid amyl ester Formula: C16H17ClO4 MolecularWeight: 308.75678

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC2=C(C=CC(=C2)CCl)OC1=O

Isomeric SMILES

CCCCCOC(=O)C1=CC2=C(C=CC(=C2)CCl)OC1=O

InChI

InChI=1S/C16H17ClO4/c1-2-3-4-7-20-15(18)13-9-12-8-11(10-17)5-6-14(12)21-16(13)19/h5-6,8-9H,2-4,7,10H2,1H3