(phenylmethyl) 4-(4-cyanophenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(4-cyanophenyl)sulfonylpiperazine-1-carboxylate Openeye Name: benzyl 4-(4-cyanophenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(4-cyanophenyl)sulfonyl-1-piperazinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(4-cyanophenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(4-cyanophenyl)sulfonylpiperazine-1-carboxylic acid benzyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C(=O)OCC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C19H19N3O4S/c20-14-16-6-8-18(9-7-16)27(24,25)22-12-10-21(11-13-22)19(23)26-15-17-4-2-1-3-5-17/h1-9H,10-13,15H2