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

Systemtic Name: [5-chloranyl-2-oxidanylidene-3-(phenylmethyl)chromen-4-yl] 2-methylpropanoate Openeye Name: (3-benzyl-5-chloro-2-oxo-chromen-4-yl) 2-methylpropanoate CAS Name: 2-methylpropanoic acid [5-chloro-2-oxo-3-(phenylmethyl)-1-benzopyran-4-yl] ester IUPAC Name: (3-benzyl-5-chloro-2-oxochromen-4-yl) 2-methylpropanoate Traditional Name: 2-methylpropionic 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:

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

Isomeric SMILES

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

InChI

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