[5-chloranyl-2-oxidanylidene-3-(phenylmethyl)chromen-4-yl] butanoate

Systemtic Name: [5-chloranyl-2-oxidanylidene-3-(phenylmethyl)chromen-4-yl] butanoate Openeye Name: (3-benzyl-5-chloro-2-oxo-chromen-4-yl) butanoate CAS Name: butanoic acid [5-chloro-2-oxo-3-(phenylmethyl)-1-benzopyran-4-yl] ester IUPAC Name: (3-benzyl-5-chloro-2-oxochromen-4-yl) butanoate Traditional Name: butyric acid (3-benzyl-5-chloro-2-keto-chromen-4-yl) ester Formula: C20H17ClO4 MolecularWeight: 356.79958

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=C(C(=O)OC2=C1C(=CC=C2)Cl)CC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)OC1=C(C(=O)OC2=C1C(=CC=C2)Cl)CC3=CC=CC=C3

InChI

InChI=1S/C20H17ClO4/c1-2-7-17(22)25-19-14(12-13-8-4-3-5-9-13)20(23)24-16-11-6-10-15(21)18(16)19/h3-6,8-11H,2,7,12H2,1H3