[4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: [4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 4-piperidin-1-ylsulfonylbenzoate Openeye Name: [4-(2-methoxy-2-oxo-ethyl)phenyl] 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid [4-(2-methoxy-2-oxoethyl)phenyl] ester IUPAC Name: [4-(2-methoxy-2-oxoethyl)phenyl] 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid [4-(2-keto-2-methoxy-ethyl)phenyl] ester Formula: C21H23NO6S MolecularWeight: 417.47542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H23NO6S/c1-27-20(23)15-16-5-9-18(10-6-16)28-21(24)17-7-11-19(12-8-17)29(25,26)22-13-3-2-4-14-22/h5-12H,2-4,13-15H2,1H3