ethyl 4-[[1,1-bis(oxidanylidene)-1-benzothiophen-4-yl]methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[[1,1-bis(oxidanylidene)-1-benzothiophen-4-yl]methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(1,1-dioxobenzothiophen-4-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[(1,1-dioxo-1-benzothiophen-4-yl)methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(1,1-dioxo-1-benzothiophen-4-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(1,1-diketobenzothiophen-4-yl)methyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H20N2O4S MolecularWeight: 336.406

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=C3C=CS(=O)(=O)C3=CC=C2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=C3C=CS(=O)(=O)C3=CC=C2

InChI

InChI=1S/C16H20N2O4S/c1-2-22-16(19)18-9-7-17(8-10-18)12-13-4-3-5-15-14(13)6-11-23(15,20)21/h3-6,11H,2,7-10,12H2,1H3