(2-cyanophenyl)methyl 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (2-cyanophenyl)methyl 4-piperidin-1-ylsulfonylbenzoate Openeye Name: (2-cyanophenyl)methyl 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid (2-cyanobenzyl) ester Formula: C20H20N2O4S MolecularWeight: 384.4488

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3C#N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H20N2O4S/c21-14-17-6-2-3-7-18(17)15-26-20(23)16-8-10-19(11-9-16)27(24,25)22-12-4-1-5-13-22/h2-3,6-11H,1,4-5,12-13,15H2