tert-butyl 4-[2-(4-chlorophenyl)selanylethyl]-3-methyl-5-oxidanylidene-2H-pyrrole-1-carboxylate

Systemtic Name: tert-butyl 4-[2-(4-chlorophenyl)selanylethyl]-3-methyl-5-oxidanylidene-2H-pyrrole-1-carboxylate Openeye Name: tert-butyl 4-[2-(4-chlorophenyl)selanylethyl]-3-methyl-5-oxo-2H-pyrrole-1-carboxylate CAS Name: 4-[2-[(4-chlorophenyl)seleno]ethyl]-3-methyl-5-oxo-2H-pyrrole-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-(4-chlorophenyl)selanylethyl]-3-methyl-5-oxo-2H-pyrrole-1-carboxylate Traditional Name: 3-[2-[(4-chlorophenyl)seleno]ethyl]-2-keto-4-methyl-3-pyrroline-1-carboxylic acid tert-butyl ester Formula: C18H22ClNO3Se MolecularWeight: 414.78518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C1)C(=O)OC(C)(C)C)CC[Se]C2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=C(C(=O)N(C1)C(=O)OC(C)(C)C)CC[Se]C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H22ClNO3Se/c1-12-11-20(17(22)23-18(2,3)4)16(21)15(12)9-10-24-14-7-5-13(19)6-8-14/h5-8H,9-11H2,1-4H3