methyl 3-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]benzoate

Systemtic Name: methyl 3-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]benzoate Openeye Name: methyl 3-[[3-(1-piperidylsulfonyl)benzoyl]amino]benzoate CAS Name: 3-[[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 3-[(3-piperidinosulfonylbenzoyl)amino]benzoic acid methyl ester Formula: C20H22N2O5S MolecularWeight: 402.46408

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C20H22N2O5S/c1-27-20(24)16-8-5-9-17(13-16)21-19(23)15-7-6-10-18(14-15)28(25,26)22-11-3-2-4-12-22/h5-10,13-14H,2-4,11-12H2,1H3,(H,21,23)