phenylsulfonyl 2-aminocarbonyl-2-[2-(3-cyanophenoxy)ethyl]piperazine-1-carboxylate

Systemtic Name: phenylsulfonyl 2-aminocarbonyl-2-[2-(3-cyanophenoxy)ethyl]piperazine-1-carboxylate Openeye Name: benzenesulfonyl 2-carbamoyl-2-[2-(3-cyanophenoxy)ethyl]piperazine-1-carboxylate CAS Name: 2-carbamoyl-2-[2-(3-cyanophenoxy)ethyl]-1-piperazinecarboxylic acid benzenesulfonyl ester IUPAC Name: benzenesulfonyl 2-carbamoyl-2-[2-(3-cyanophenoxy)ethyl]piperazine-1-carboxylate Traditional Name: 2-carbamoyl-2-[2-(3-cyanophenoxy)ethyl]piperazine-1-carboxylic acid besyl ester Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)(CCOC2=CC=CC(=C2)C#N)C(=O)N)C(=O)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(C(CN1)(CCOC2=CC=CC(=C2)C#N)C(=O)N)C(=O)OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H22N4O6S/c22-14-16-5-4-6-17(13-16)30-12-9-21(19(23)26)15-24-10-11-25(21)20(27)31-32(28,29)18-7-2-1-3-8-18/h1-8,13,24H,9-12,15H2,(H2,23,26)