(2,3-dimethoxyphenyl)methyl 4-piperidin-1-ylsulfonylbenzoate

Systemtic Name: (2,3-dimethoxyphenyl)methyl 4-piperidin-1-ylsulfonylbenzoate Openeye Name: (2,3-dimethoxyphenyl)methyl 4-(1-piperidylsulfonyl)benzoate CAS Name: 4-(1-piperidinylsulfonyl)benzoic acid (2,3-dimethoxyphenyl)methyl ester IUPAC Name: (2,3-dimethoxyphenyl)methyl 4-piperidin-1-ylsulfonylbenzoate Traditional Name: 4-piperidinosulfonylbenzoic acid o-veratryl ester Formula: C21H25NO6S MolecularWeight: 419.4913

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC1=CC=CC(=C1OC)COC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H25NO6S/c1-26-19-8-6-7-17(20(19)27-2)15-28-21(23)16-9-11-18(12-10-16)29(24,25)22-13-4-3-5-14-22/h6-12H,3-5,13-15H2,1-2H3