ethyl 4-(4-iodophenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(4-iodophenyl)sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-(4-iodophenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(4-iodophenyl)sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-iodophenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(4-iodophenyl)sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C13H17IN2O4S MolecularWeight: 424.25455

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)I

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C13H17IN2O4S/c1-2-20-13(17)15-7-9-16(10-8-15)21(18,19)12-5-3-11(14)4-6-12/h3-6H,2,7-10H2,1H3