[4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]methyl 3-(2-chloranyl-2-oxidanylidene-ethyl)benzoate

Systemtic Name: [4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]methyl 3-(2-chloranyl-2-oxidanylidene-ethyl)benzoate Openeye Name: (4-tert-butoxycarbonylphenyl)methyl 3-(2-chloro-2-oxo-ethyl)benzoate CAS Name: 3-(2-chloro-2-oxoethyl)benzoic acid [4-[(2-methylpropan-2-yl)oxy-oxomethyl]phenyl]methyl ester IUPAC Name: [4-[(2-methylpropan-2-yl)oxycarbonyl]phenyl]methyl 3-(2-chloro-2-oxoethyl)benzoate Traditional Name: 3-(2-chloro-2-keto-ethyl)benzoic acid (4-tert-butoxycarbonylbenzyl) ester Formula: C21H21ClO5 MolecularWeight: 388.84144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)CC(=O)Cl

Isomeric SMILES

CC(C)(C)OC(=O)C1=CC=C(C=C1)COC(=O)C2=CC(=CC=C2)CC(=O)Cl

InChI

InChI=1S/C21H21ClO5/c1-21(2,3)27-20(25)16-9-7-14(8-10-16)13-26-19(24)17-6-4-5-15(11-17)12-18(22)23/h4-11H,12-13H2,1-3H3