methyl 3-(4-piperidin-1-ylsulfonylphenyl)carbonyloxybenzoate

Systemtic Name: methyl 3-(4-piperidin-1-ylsulfonylphenyl)carbonyloxybenzoate Openeye Name: methyl 3-[4-(1-piperidylsulfonyl)benzoyl]oxybenzoate CAS Name: 3-[oxo-[4-(1-piperidinylsulfonyl)phenyl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 3-(4-piperidin-1-ylsulfonylbenzoyl)oxybenzoate Traditional Name: 3-(4-piperidinosulfonylbenzoyl)oxybenzoic acid methyl ester Formula: C20H21NO6S MolecularWeight: 403.44884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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