phenyl 4-(4-ethoxycarbonylphenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: phenyl 4-(4-ethoxycarbonylphenyl)sulfonylpiperazine-1-carboxylate Openeye Name: phenyl 4-(4-ethoxycarbonylphenyl)sulfonylpiperazine-1-carboxylate CAS Name: 4-(4-ethoxycarbonylphenyl)sulfonyl-1-piperazinecarboxylic acid phenyl ester IUPAC Name: phenyl 4-(4-ethoxycarbonylphenyl)sulfonylpiperazine-1-carboxylate Traditional Name: 4-(4-carbethoxyphenyl)sulfonylpiperazine-1-carboxylic acid phenyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)OC3=CC=CC=C3

InChI

InChI=1S/C20H22N2O6S/c1-2-27-19(23)16-8-10-18(11-9-16)29(25,26)22-14-12-21(13-15-22)20(24)28-17-6-4-3-5-7-17/h3-11H,2,12-15H2,1H3