methyl 4-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]benzoate

Systemtic Name: methyl 4-[(3-piperidin-1-ylsulfonylphenyl)carbonylamino]benzoate Openeye Name: methyl 4-[[3-(1-piperidylsulfonyl)benzoyl]amino]benzoate CAS Name: 4-[[oxo-[3-(1-piperidinylsulfonyl)phenyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-piperidin-1-ylsulfonylbenzoyl)amino]benzoate Traditional Name: 4-[(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=C(C=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

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

InChI

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