(4-methoxycarbonylphenyl) 3-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (4-methoxycarbonylphenyl) 3-piperidin-1-ylsulfonylbenzoate Openeye Name: (4-methoxycarbonylphenyl) 3-(1-piperidylsulfonyl)benzoate CAS Name: 3-(1-piperidinylsulfonyl)benzoic acid (4-methoxycarbonylphenyl) ester IUPAC Name: (4-methoxycarbonylphenyl) 3-piperidin-1-ylsulfonylbenzoate Traditional Name: 3-piperidinosulfonylbenzoic acid (4-carbomethoxyphenyl) ester Formula: C20H21NO6S MolecularWeight: 403.44884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO6S/c1-26-19(22)15-8-10-17(11-9-15)27-20(23)16-6-5-7-18(14-16)28(24,25)21-12-3-2-4-13-21/h5-11,14H,2-4,12-13H2,1H3